tert-Butyl 2-(((4-(bis(tert-butoxycarbonyl)amino)butyl)(5,6,7,8-tetrahydroquinolin-8-yl)amino)methyl)-1H-benzo[d]imidazole-1-carboxylate, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H51N5O6
Molecular Weight	649.82
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of tert-Butyl 2-(((4-(bis(tert-butoxycarbonyl)amino)butyl)(5,6,7,8-tetrahydroquinolin-8-yl)amino)methyl)-1H-benzo[d]imidazole-1-carboxylate, (S)-

Structure Search

SMILES

CC(C)(C)OC(=O)N(CCCCN(CC1=NC2=C(C=CC=C2)N1C(=O)OC(C)(C)C)[C@H]3CCCC4=CC=CN=C34)C(=O)OC(C)(C)C

InChI

InChIKey=AOYKHEPACZTMPP-NDEPHWFRSA-N

InChI=1S/C36H51N5O6/c1-34(2,3)45-31(42)40(32(43)46-35(4,5)6)23-13-12-22-39(28-20-14-16-25-17-15-21-37-30(25)28)24-29-38-26-18-10-11-19-27(26)41(29)33(44)47-36(7,8)9/h10-11,15,17-19,21,28H,12-14,16,20,22-24H2,1-9H3/t28-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C36H51N5O6
Molecular Weight	649.82
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 18:18:45 GMT 2025` Edited by `admin` on `Wed Apr 02 18:18:45 GMT 2025`
Record UNII	9W7SBY9CZX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

tert-Butyl 2-(((4-(bis(tert-butoxycarbonyl)amino)butyl)(5,6,7,8-tetrahydroquinolin-8-yl)amino)methyl)-1H-benzo[d]imidazole-1-carboxylate, (S)-

Systematic Name

English

(S)-tert-Butyl 2-(((4-(bis(tert-butoxycarbonyl)amino)butyl)(5,6,7,8-tetrahydroquinolin-8-yl)amino)methyl)-1H-benzo[d]imidazole-1-carboxylate

Preferred Name

English

1H-Benzimidazole-1-carboxylic acid, 2-[[[4-[bis[(1,1-dimethylethoxy)carbonyl]amino]butyl][(8S)-5,6,7,8-tetrahydro-8-quinolinyl]amino]methyl]-, 1,1-dimethylethyl ester

Systematic Name

English

tert-Butyl 2-[[4-[bis(tert-butoxycarbonyl)amino]butyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]methyl]benzimidazole-1-carboxylate

Systematic Name

English

1,1-Dimethylethyl 2-[[[4-[bis[(1,1-dimethylethoxy)carbonyl]amino]butyl][(8S)-5,6,7,8-tetrahydro-8-quinolinyl]amino]methyl]-1H-benzimidazole-1-carboxylate

Systematic Name

English

Code System Code Type Description

CAS

865202-97-7

Created by admin on Wed Apr 02 18:18:45 GMT 2025 , Edited by admin on Wed Apr 02 18:18:45 GMT 2025

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FDA UNII

9W7SBY9CZX

Created by admin on Wed Apr 02 18:18:45 GMT 2025 , Edited by admin on Wed Apr 02 18:18:45 GMT 2025

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PUBCHEM

16050247

Created by admin on Wed Apr 02 18:18:45 GMT 2025 , Edited by admin on Wed Apr 02 18:18:45 GMT 2025

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