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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H16ClN3O5S2
Molecular Weight 441.909
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-(3-(2-CHLORO-3-THIOPHENE)-5-METHYL-4-ISOXAZOLYL)PENICILLIN

SMILES

[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C3=C(C)ON=C3C4=C(Cl)SC=C4)C(O)=O

InChI

InChIKey=OHXFUTDGKVLAAN-JRPNMDOOSA-N
InChI=1S/C17H16ClN3O5S2/c1-6-8(9(20-26-6)7-4-5-27-12(7)18)13(22)19-10-14(23)21-11(16(24)25)17(2,3)28-15(10)21/h4-5,10-11,15H,1-3H3,(H,19,22)(H,24,25)/t10-,11+,15-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
6-(3-(2-CHLORO-3-THIOPHENE)-5-METHYL-4-ISOXAZOLYL)PENICILLIN
Common Name English
(2S,5R,6R)-6-((3-(2-CHLOROTHIOPHEN-3-YL)-5-METHYL-1,2-OXAZOLE-4-CARBONYL)AMINO)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID
Systematic Name English
4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-(3-(2-CHLORO-3-THIENYL)-5-METHYL-4-ISOXAZOLECARBOXAMIDO)-3,3-DIMETHYL-7-OXO-
Systematic Name English
Code System Code Type Description
PUBCHEM
133082695
Created by admin on Sat Dec 16 18:36:18 GMT 2023 , Edited by admin on Sat Dec 16 18:36:18 GMT 2023
PRIMARY
CAS
14465-04-4
Created by admin on Sat Dec 16 18:36:18 GMT 2023 , Edited by admin on Sat Dec 16 18:36:18 GMT 2023
PRIMARY
FDA UNII
S4T87DAL8K
Created by admin on Sat Dec 16 18:36:18 GMT 2023 , Edited by admin on Sat Dec 16 18:36:18 GMT 2023
PRIMARY