(2Z)-4-(4-chlorophenyl)-2-(furan-2-ylmethylidene)-4-oxidanylidene-N-(phenylmethyl)butanethioamide

Systemtic Name: (2Z)-4-(4-chlorophenyl)-2-(furan-2-ylmethylidene)-4-oxidanylidene-N-(phenylmethyl)butanethioamide Openeye Name: (2Z)-N-benzyl-4-(4-chlorophenyl)-2-(2-furylmethylene)-4-oxo-butanethioamide CAS Name: (2Z)-4-(4-chlorophenyl)-2-(2-furanylmethylidene)-4-oxo-N-(phenylmethyl)butanethioamide IUPAC Name: (2Z)-N-benzyl-4-(4-chlorophenyl)-2-(furan-2-ylmethylidene)-4-oxobutanethioamide Traditional Name: (Z)-N-benzyl-2-[2-(4-chlorophenyl)-2-keto-ethyl]-3-(2-furyl)thioacrylamide Formula: C22H18ClNO2S MolecularWeight: 395.90182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)C(=CC2=CC=CO2)CC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)/C(=C\C2=CC=CO2)/CC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H18ClNO2S/c23-19-10-8-17(9-11-19)21(25)14-18(13-20-7-4-12-26-20)22(27)24-15-16-5-2-1-3-6-16/h1-13H,14-15H2,(H,24,27)/b18-13-