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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H18ClN7O3S
Molecular Weight 423.877
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-(D-2-AMINO-2-(3-CHLORO-4-HYDROXYPHENYL)ACETAMIDO)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPT-2-YL-5-TETRAZOLE

SMILES

[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@H](N)C3=CC=C(O)C(Cl)=C3)C4=NN=NN4

InChI

InChIKey=XXZMHEZAXBRSQW-YYHMBLRTSA-N
InChI=1S/C16H18ClN7O3S/c1-16(2)11(12-20-22-23-21-12)24-14(27)10(15(24)28-16)19-13(26)9(18)6-3-4-8(25)7(17)5-6/h3-5,9-11,15,25H,18H2,1-2H3,(H,19,26)(H,20,21,22,23)/t9-,10-,11+,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H18ClN7O3S
Molecular Weight 423.877
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:23:07 GMT 2023
Edited
by admin
on Fri Dec 15 15:23:07 GMT 2023
Record UNII
YA15Q73TW3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-(D-2-AMINO-2-(3-CHLORO-4-HYDROXYPHENYL)ACETAMIDO)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPT-2-YL-5-TETRAZOLE
Common Name English
6-(D-2-AMINO-2-(3-CHLORO-4-HYDROXYPHENYL)ACETAMIDO)-2,2-DIMETHYL-3-(5-TETRAZOLYL)PENAM
Common Name English
BENZENEACETAMIDE, .ALPHA.-AMINO-3-CHLORO-N-(3,3-DIMETHYL-7-OXO-2-(1H-TETRAZOL-5-YL)-4-THIA-1-AZABICYCLO(3.2.0)HEPT-6-YL)-4-HYDROXY-, (2S-(2.ALPHA.,5.ALPHA.,6.BETA.(S*)))-
Common Name English
Code System Code Type Description
PUBCHEM
145722620
Created by admin on Fri Dec 15 15:23:07 GMT 2023 , Edited by admin on Fri Dec 15 15:23:07 GMT 2023
PRIMARY
FDA UNII
YA15Q73TW3
Created by admin on Fri Dec 15 15:23:07 GMT 2023 , Edited by admin on Fri Dec 15 15:23:07 GMT 2023
PRIMARY
CAS
56852-45-0
Created by admin on Fri Dec 15 15:23:07 GMT 2023 , Edited by admin on Fri Dec 15 15:23:07 GMT 2023
PRIMARY