propan-2-yl 7-azanyl-8-oxidanylidene-3-(1,2,3-thiadiazol-5-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: propan-2-yl 7-azanyl-8-oxidanylidene-3-(1,2,3-thiadiazol-5-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: isopropyl 7-amino-8-oxo-3-(thiadiazol-5-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-amino-8-oxo-3-[(5-thiadiazolylthio)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 7-amino-8-oxo-3-(thiadiazol-5-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-amino-8-keto-3-[(thiadiazol-5-ylthio)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid isopropyl ester Formula: C13H16N4O3S3 MolecularWeight: 372.48614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(CSC2N1C(=O)C2N)CSC3=CN=NS3

Isomeric SMILES

CC(C)OC(=O)C1=C(CSC2N1C(=O)C2N)CSC3=CN=NS3

InChI

InChI=1S/C13H16N4O3S3/c1-6(2)20-13(19)10-7(4-21-8-3-15-16-23-8)5-22-12-9(14)11(18)17(10)12/h3,6,9,12H,4-5,14H2,1-2H3