APTAZAPINE MALEATE, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H19N3.C4H4O4
Molecular Weight	369.4143
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.[H][C@@]12CN(C)CCN1C3=C(CN4C=CC=C24)C=CC=C3

InChI

InChIKey=JJTOHZLQMBVMPF-ZSJYYTRTSA-N

InChI=1S/C16H19N3.C4H4O4/c1-17-9-10-19-14-6-3-2-5-13(14)11-18-8-4-7-15(18)16(19)12-17;5-3(6)1-2-4(7)8/h2-8,16H,9-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t16-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C16H19N3
Molecular Weight	253.3422
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 `Sat Dec 16 09:42:55 GMT 2023` Edited by `admin` on `Sat Dec 16 09:42:55 GMT 2023`
Record UNII	YCX29PO1C8
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

APTAZAPINE MALEATE, (S)-

Common Name

English

2H,10H-PYRAZINO(1,2-A)PYRROLO(2,1-C)(1,4)BENZODIAZEPINE, 1,3,4,14B-TETRAHYDRO-2-METHYL-, (-)-, (2Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

YCX29PO1C8

Created by admin on Sat Dec 16 09:42:55 GMT 2023 , Edited by admin on Sat Dec 16 09:42:55 GMT 2023

PRIMARY

CAS

81729-74-0

Created by admin on Sat Dec 16 09:42:55 GMT 2023 , Edited by admin on Sat Dec 16 09:42:55 GMT 2023

PRIMARY

PUBCHEM

76969157

Created by admin on Sat Dec 16 09:42:55 GMT 2023 , Edited by admin on Sat Dec 16 09:42:55 GMT 2023

PRIMARY

Related Record Type Details


					7X768418RT

APTAZAPINE MALEATE

RACEMATE -> ENANTIOMER