Hexyl N-[[4-[[[5-[[(3-amino-3-oxopropyl)-2-pyridinylamino]carbonyl]-1-methyl-1H-benzimidazol-2-yl]methyl]amino]phenyl]iminomethyl]carbamate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C32H38N8O4
Molecular Weight	598.6953
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Hexyl N-[[4-[[[5-[[(3-amino-3-oxopropyl)-2-pyridinylamino]carbonyl]-1-methyl-1H-benzimidazol-2-yl]methyl]amino]phenyl]iminomethyl]carbamate

Structure Search

SMILES

CCCCCCOC(=O)NC(=N)C1=CC=C(NCC2=NC3=CC(=CC=C3N2C)C(=O)N(CCC(N)=O)C4=CC=CC=N4)C=C1

InChI

InChIKey=QQTDTILRFNZOGU-UHFFFAOYSA-N

InChI=1S/C32H38N8O4/c1-3-4-5-8-19-44-32(43)38-30(34)22-10-13-24(14-11-22)36-21-29-37-25-20-23(12-15-26(25)39(29)2)31(42)40(18-16-27(33)41)28-9-6-7-17-35-28/h6-7,9-15,17,20,36H,3-5,8,16,18-19,21H2,1-2H3,(H2,33,41)(H2,34,38,43)

HIDE SMILES / InChI

Molecular Formula	C32H38N8O4
Molecular Weight	598.6953
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:15:09 GMT 2023` Edited by `admin` on `Sat Dec 16 19:15:09 GMT 2023`
Record UNII	S675WG3RT9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Hexyl N-[[4-[[[5-[[(3-amino-3-oxopropyl)-2-pyridinylamino]carbonyl]-1-methyl-1H-benzimidazol-2-yl]methyl]amino]phenyl]iminomethyl]carbamate

Systematic Name

English

Carbamic acid, N-[[4-[[[5-[[(3-amino-3-oxopropyl)-2-pyridinylamino]carbonyl]-1-methyl-1H-benzimidazol-2-yl]methyl]amino]phenyl]iminomethyl]-, hexyl ester

Systematic Name

English

Code System Code Type Description

PUBCHEM

89147692

Created by admin on Sat Dec 16 19:15:09 GMT 2023 , Edited by admin on Sat Dec 16 19:15:09 GMT 2023

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CAS

1580491-16-2

Created by admin on Sat Dec 16 19:15:09 GMT 2023 , Edited by admin on Sat Dec 16 19:15:09 GMT 2023

PRIMARY

FDA UNII

S675WG3RT9

Created by admin on Sat Dec 16 19:15:09 GMT 2023 , Edited by admin on Sat Dec 16 19:15:09 GMT 2023

PRIMARY