8-CHLORO-5-METHYL-11-(4-METHYLPIPERAZIN-1-YL)-5H-PYRROLO(1,2-B)(1,2,5)BENZOTRIAZEPINE SUCCINATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H20ClN5.C4H6O4
Molecular Weight	447.915
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 8-CHLORO-5-METHYL-11-(4-METHYLPIPERAZIN-1-YL)-5H-PYRROLO(1,2-B)(1,2,5)BENZOTRIAZEPINE SUCCINATE

SMILES

OC(=O)CCC(O)=O.CN1CCN(CC1)C2=NC3=CC(Cl)=CC=C3N(C)N4C=CC=C24

InChI

InChIKey=NDWPAMUUPQMZQZ-UHFFFAOYSA-N

InChI=1S/C17H20ClN5.C4H6O4/c1-20-8-10-22(11-9-20)17-16-4-3-7-23(16)21(2)15-6-5-13(18)12-14(15)19-17;5-3(6)1-2-4(7)8/h3-7,12H,8-11H2,1-2H3;1-2H2,(H,5,6)(H,7,8)

HIDE SMILES / InChI

Molecular Formula	C4H6O4
Molecular Weight	118.088
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Molecular Formula	C17H20ClN5
Molecular Weight	329.827
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Approval Year

Substance Class	Chemical
Record UNII	OY3FR97QJK
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

8-CHLORO-5-METHYL-11-(4-METHYLPIPERAZIN-1-YL)-5H-PYRROLO(1,2-B)(1,2,5)BENZOTRIAZEPINE SUCCINATE

Systematic Name

English

BUTANEDIOIC ACID, COMPD. WITH 8-CHLORO-5-METHYL-11-(4-METHYL-1-PIPERAZINYL)-5H-PYRROLO(1,2-B)(1,2,5)BENZOTRIAZEPINE

Systematic Name

English

Code System

Code

Type

Description

CAS

79700-41-7

NON-SPECIFIC STOICHIOMETRY

FDA UNII

OY3FR97QJK

PRIMARY

PUBCHEM

24835891

PRIMARY

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SUCCINIC ACID

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					9BC5X7Z06A

8-CHLORO-5-METHYL-11-(4-METHYLPIPERAZIN-1-YL)-5H-PYRROLO(1,2-B)(1,2,5)BENZOTRIAZEPINE

PARENT -> SALT/SOLVATE