3-[2-(azanylmethylideneamino)propylsulfanyl]-6-methoxy-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-[2-(azanylmethylideneamino)propylsulfanyl]-6-methoxy-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-[2-(aminomethyleneamino)propylsulfanyl]-6-methoxy-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-[2-(aminomethylideneamino)propylthio]-6-methoxy-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-[2-(aminomethylideneamino)propylsulfanyl]-6-methoxy-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-[2-(aminomethyleneamino)propylthio]-7-keto-6-methoxy-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C11H15N3O4S2 MolecularWeight: 317.3845

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=C(N2C(S1)C(C2=O)OC)C(=O)O)N=CN

Isomeric SMILES

CC(CSC1=C(N2C(S1)C(C2=O)OC)C(=O)O)N=CN

InChI

InChI=1S/C11H15N3O4S2/c1-5(13-4-12)3-19-11-6(10(16)17)14-8(15)7(18-2)9(14)20-11/h4-5,7,9H,3H2,1-2H3,(H2,12,13)(H,16,17)