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Details

Stereochemistry MIXED
Molecular Formula C18H23N9O4S3
Molecular Weight 525.628
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-[[2-(2-Amino-4-thiazolyl)acetyl]amino]-3-[[[1-[2-(dimethylamino)ethyl]-1H-tetrazol-5-yl]thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid

SMILES

CN(C)CCN1N=NN=C1SCC2=CSC3C(NC(=O)CC4=CSC(N)=N4)C(=O)N3C2C(O)=O

InChI

InChIKey=DTZXOJSIJQTTJR-UHFFFAOYSA-N
InChI=1S/C18H23N9O4S3/c1-25(2)3-4-26-18(22-23-24-26)34-7-9-6-32-15-12(14(29)27(15)13(9)16(30)31)21-11(28)5-10-8-33-17(19)20-10/h6,8,12-13,15H,3-5,7H2,1-2H3,(H2,19,20)(H,21,28)(H,30,31)

HIDE SMILES / InChI

Molecular Formula C18H23N9O4S3
Molecular Weight 525.628
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
FZU2EQE2F9
Record Status Validated (UNII)
Record Version