7-azanyl-3-(3-bromanyl-4-phenyl-phenyl)sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-(3-bromanyl-4-phenyl-phenyl)sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-3-(3-bromo-4-phenyl-phenyl)sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-[(3-bromo-4-phenylphenyl)thio]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-(3-bromo-4-phenylphenyl)sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-3-[(3-bromo-4-phenyl-phenyl)thio]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C19H15BrN2O3S2 MolecularWeight: 463.368

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)SC3=CC(=C(C=C3)C4=CC=CC=C4)Br

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)SC3=CC(=C(C=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C19H15BrN2O3S2/c20-13-8-11(6-7-12(13)10-4-2-1-3-5-10)27-14-9-26-18-15(21)17(23)22(18)16(14)19(24)25/h1-8,15,18H,9,21H2,(H,24,25)