2-[2-[2-oxidanylidene-1-phenyl-2-[(phenylmethyl)amino]ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-oxidanylidene-1-phenyl-2-[(phenylmethyl)amino]ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[2-(benzylamino)-2-oxo-1-phenyl-ethyl]sulfanylthiazol-4-yl]acetic acid CAS Name: 2-[2-[[2-oxo-1-phenyl-2-[(phenylmethyl)amino]ethyl]thio]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[2-(benzylamino)-2-oxo-1-phenylethyl]sulfanyl-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[2-(benzylamino)-2-keto-1-phenyl-ethyl]thio]thiazol-4-yl]acetic acid Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(C2=CC=CC=C2)SC3=NC(=CS3)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(C2=CC=CC=C2)SC3=NC(=CS3)CC(=O)O

InChI

InChI=1S/C20H18N2O3S2/c23-17(24)11-16-13-26-20(22-16)27-18(15-9-5-2-6-10-15)19(25)21-12-14-7-3-1-4-8-14/h1-10,13,18H,11-12H2,(H,21,25)(H,23,24)