BAY-V-3522 ANHYDROUS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H19N5O4S2
Molecular Weight	445.515
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12SCC(\C=C/C)=C(N1C(=O)[C@H]2NC(=O)[C@H](N)C3=CC4=C(C=C3)N=C(N)S4)C(O)=O

InChI

InChIKey=GSPMBQQDLRBMID-AGGBKSKLSA-N

InChI=1S/C19H19N5O4S2/c1-2-3-9-7-29-17-13(16(26)24(17)14(9)18(27)28)23-15(25)12(20)8-4-5-10-11(6-8)30-19(21)22-10/h2-6,12-13,17H,7,20H2,1H3,(H2,21,22)(H,23,25)(H,27,28)/b3-2-/t12-,13-,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H19N5O4S2
Molecular Weight	445.515
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:55:50 GMT 2023` Edited by `admin` on `Sat Dec 16 09:55:50 GMT 2023`
Record UNII	75HLV3QOH7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BAY-V-3522 ANHYDROUS

Code

English

5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-((AMINO(2-AMINO-6-BENZOTHIAZOLYL)ACETYL)AMINO)-8-OXO-3-(1-PROPENYL)-, (6R-(3(Z),6ALPHA,7BETA(R*)))-

Common Name

English

5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2R)-AMINO(2-AMINO-6-BENZOTHIAZOLYL)ACETYL)AMINO)-8-OXO-3-(1Z)-1-PROPENYL-, (6R,7R)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

6440069

Created by admin on Sat Dec 16 09:55:50 GMT 2023 , Edited by admin on Sat Dec 16 09:55:50 GMT 2023

PRIMARY

CAS

120635-27-0

Created by admin on Sat Dec 16 09:55:50 GMT 2023 , Edited by admin on Sat Dec 16 09:55:50 GMT 2023

PRIMARY

FDA UNII

75HLV3QOH7

Created by admin on Sat Dec 16 09:55:50 GMT 2023 , Edited by admin on Sat Dec 16 09:55:50 GMT 2023

PRIMARY

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