(E)-5-azanyl-4-(4-chlorophenyl)sulfanyl-3-oxidanylidene-5-phenyl-pent-4-enoic acid

Systemtic Name: (E)-5-azanyl-4-(4-chlorophenyl)sulfanyl-3-oxidanylidene-5-phenyl-pent-4-enoic acid Openeye Name: (E)-5-amino-4-(4-chlorophenyl)sulfanyl-3-oxo-5-phenyl-pent-4-enoic acid CAS Name: (E)-5-amino-4-[(4-chlorophenyl)thio]-3-oxo-5-phenyl-4-pentenoic acid IUPAC Name: (E)-5-amino-4-(4-chlorophenyl)sulfanyl-3-oxo-5-phenylpent-4-enoic acid Traditional Name: (E)-5-amino-4-[(4-chlorophenyl)thio]-3-keto-5-phenyl-pent-4-enoic acid Formula: C17H14ClNO3S MolecularWeight: 347.81596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(C(=O)CC(=O)O)SC2=CC=C(C=C2)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)/C(=C(/C(=O)CC(=O)O)\SC2=CC=C(C=C2)Cl)/N

InChI

InChI=1S/C17H14ClNO3S/c18-12-6-8-13(9-7-12)23-17(14(20)10-15(21)22)16(19)11-4-2-1-3-5-11/h1-9H,10,19H2,(H,21,22)/b17-16+