CLOROTEPINE MALEATE, (+)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H21ClN2S.C4H4O4
Molecular Weight	460.974
Optical Activity	( + )
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.CN1CCN(CC1)[C@H]2CC3=CC=CC=C3SC4=C2C=C(Cl)C=C4

InChI

InChIKey=GWKBZIADWSOIQV-HNUXRKMMSA-N

InChI=1S/C19H21ClN2S.C4H4O4/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19;5-3(6)1-2-4(7)8/h2-7,13,17H,8-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t17-;/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	C19H21ClN2S
Molecular Weight	344.901
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 05:45:40 GMT 2023` Edited by `admin` on `Sat Dec 16 05:45:40 GMT 2023`
Record UNII	F3Z4F45ZZ7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CLOROTEPINE MALEATE, (+)-

Common Name

English

PIPERAZINE, 1-(8-CHLORO-10,11-DIHYDRODIBENZO(B,F)THIEPIN-10-YL)-4-METHYL-, (+)-, (2Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

PIPERAZINE, 1-(8-CHLORO-10,11-DIHYDRODIBENZO(B,F)THIEPIN-10-YL)-4-METHYL-, (+)-, (Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

F3Z4F45ZZ7

Created by admin on Sat Dec 16 05:45:40 GMT 2023 , Edited by admin on Sat Dec 16 05:45:40 GMT 2023

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PUBCHEM

76960317

Created by admin on Sat Dec 16 05:45:40 GMT 2023 , Edited by admin on Sat Dec 16 05:45:40 GMT 2023

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CAS

41931-07-1

Created by admin on Sat Dec 16 05:45:40 GMT 2023 , Edited by admin on Sat Dec 16 05:45:40 GMT 2023

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