MDL-108207DA FREE BASE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C38H49N5O5
Molecular Weight	655.8262
Optical Activity	( + )
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCOCCN1C(=NC2=C1C=CC=C2)N3CCCN(CC[C@@]4(CCN(C4)C(=O)C5=CC(OC)=C(OC)C(OC)=C5)C6=CC=CC=C6)CC3

InChI

InChIKey=RFKYZHFDFJPEPT-LHEWISCISA-N

InChI=1S/C38H49N5O5/c1-5-48-25-24-43-32-15-10-9-14-31(32)39-37(43)41-19-11-18-40(22-23-41)20-16-38(30-12-7-6-8-13-30)17-21-42(28-38)36(44)29-26-33(45-2)35(47-4)34(27-29)46-3/h6-10,12-15,26-27H,5,11,16-25,28H2,1-4H3/t38-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C38H49N5O5
Molecular Weight	655.8262
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 `Mon Mar 31 22:41:36 GMT 2025` Edited by `admin` on `Mon Mar 31 22:41:36 GMT 2025`
Record UNII	TG6HVB6BTC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MDL-108207DA FREE BASE

Common Name

English

METHANONE, ((3R)-3-(2-(4-(1-(2-ETHOXYETHYL)-1H-BENZIMIDAZOL-2-YL)HEXAHYDRO-1H-1,4-DIAZEPIN-1-YL)ETHYL)-3-PHENYL-1-PYRROLIDINYL)(3,4,5-TRIMETHOXYPHENYL)-

Preferred Name

English

((3R)-3-(2-(4-(1-(2-ETHOXYETHYL)-1H-BENZIMIDAZOL-2-YL)HEXAHYDRO-1H-1,4-DIAZEPIN-1-YL)ETHYL)-3-PHENYL-1-PYRROLIDINYL)(3,4,5-TRIMETHOXYPHENYL)METHANONE

Systematic Name

English

PYRROLIDINE, 3-(2-(4-(1-(2-ETHOXYETHYL)-1H-BENZIMIDAZOL-2-YL)HEXAHYDRO-1H-1,4-DIAZEPIN-1-YL)ETHYL)-3-PHENYL-1-(3,4,5-TRIMETHOXYBENZOYL)-, (R)-

Systematic Name

English

Code System Code Type Description

CAS

205121-84-2

Created by admin on Mon Mar 31 22:41:37 GMT 2025 , Edited by admin on Mon Mar 31 22:41:37 GMT 2025

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PUBCHEM

156613808

Created by admin on Mon Mar 31 22:41:37 GMT 2025 , Edited by admin on Mon Mar 31 22:41:37 GMT 2025

PRIMARY

FDA UNII

TG6HVB6BTC

Created by admin on Mon Mar 31 22:41:37 GMT 2025 , Edited by admin on Mon Mar 31 22:41:37 GMT 2025

PRIMARY

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