[2-(4-acetamidophenyl)-2-oxidanylidene-ethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate

Systemtic Name: [2-(4-acetamidophenyl)-2-oxidanylidene-ethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Openeye Name: [2-(4-acetamidophenyl)-2-oxo-ethyl] (Z)-2,3-bis(2-thienyl)prop-2-enoate CAS Name: (Z)-2,3-dithiophen-2-yl-2-propenoic acid [2-(4-acetamidophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidophenyl)-2-oxoethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Traditional Name: (Z)-2,3-bis(2-thienyl)acrylic acid [2-(4-acetamidophenyl)-2-keto-ethyl] ester Formula: C21H17NO4S2 MolecularWeight: 411.49398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C(=CC2=CC=CS2)C3=CC=CS3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)/C(=C/C2=CC=CS2)/C3=CC=CS3

InChI

InChI=1S/C21H17NO4S2/c1-14(23)22-16-8-6-15(7-9-16)19(24)13-26-21(25)18(20-5-3-11-28-20)12-17-4-2-10-27-17/h2-12H,13H2,1H3,(H,22,23)/b18-12+