VABICASERIN HYDROCHLORIDE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H20N2.ClH
Molecular Weight	264.794
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of VABICASERIN HYDROCHLORIDE

Structure Search

SMILES

Cl.[H][C@@]12CCC[C@]1([H])C3=C4N(C2)CCNCC4=CC=C3

InChI

InChIKey=PYPPENBDXAWXJC-QNTKWALQSA-N

InChI=1S/C15H20N2.ClH/c1-3-11-9-16-7-8-17-10-12-4-2-5-13(12)14(6-1)15(11)17;/h1,3,6,12-13,16H,2,4-5,7-10H2;1H/t12-,13-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C15H20N2
Molecular Weight	228.3327
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
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 `Fri Dec 15 15:43:18 UTC 2023` Edited by `admin` on `Fri Dec 15 15:43:18 UTC 2023`
Record UNII	2759C7222C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VABICASERIN HYDROCHLORIDE

Official Name

English

CYCLOPENTA(4,5)PYRIDO(3,2,1-JK)(1,4)BENZODIAZEPINE, 4,5,6,7,9,9A,10,11,12,12A-DECAHYDRO-, HYDROCHLORIDE (1:1), (9AR,12AS)-

Common Name

English

SCA-136

Code

English

Vabicaserin hydrochloride [WHO-DD]

Common Name

English

(-)-(9AR*,12AS*)-4,5,6,7,9,9A,10,11,12,12A-DECAHYDROCYCLOPENTA(4,5)PYRIDO(3,2,1-JK)(1,4)BENZODIAZEPINE MONOHYDROCHLORIDE

Common Name

English

VABICASERIN HYDROCHLORIDE [USAN]

Common Name

English

CYCLOPENTA(4,5)PYRIDO(3,2,1-JK)(1,4)BENZODIAZEPINE, 4,5,6,7,9,9A,10,11,12,12A-DECAHYDRO-, MONOHYDROCHLORIDE, (9AR,12AS)-REL-(-)-

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C47794

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

Code System Code Type Description

USAN

RR-97

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

PRIMARY

CAS

887258-94-8

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

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DRUG BANK

DBSALT002131

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

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EVMPD

SUB32955

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

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FDA UNII

2759C7222C

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

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NCI_THESAURUS

C142993

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

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SMS_ID

100000125907

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

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ChEMBL

CHEMBL2110670

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

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PUBCHEM

11521821

Created by admin on Fri Dec 15 15:43:18 UTC 2023 , Edited by admin on Fri Dec 15 15:43:18 UTC 2023

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