7-azanyl-8-oxidanylidene-3-(2-phenyl-1,3-thiazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-8-oxidanylidene-3-(2-phenyl-1,3-thiazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-8-oxo-3-(2-phenylthiazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-8-oxo-3-(2-phenyl-5-thiazolyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-8-oxo-3-(2-phenyl-1,3-thiazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-8-keto-3-(2-phenylthiazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C16H13N3O3S2 MolecularWeight: 359.42272

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)C3=CN=C(S3)C4=CC=CC=C4

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)C3=CN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C16H13N3O3S2/c17-11-14(20)19-12(16(21)22)9(7-23-15(11)19)10-6-18-13(24-10)8-4-2-1-3-5-8/h1-6,11,15H,7,17H2,(H,21,22)