[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate

Systemtic Name: [2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Openeye Name: [2-[N-(cyanomethyl)anilino]-2-oxo-ethyl] (Z)-2,3-bis(2-thienyl)prop-2-enoate CAS Name: (Z)-2,3-dithiophen-2-yl-2-propenoic acid [2-[N-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(cyanomethyl)anilino]-2-oxoethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Traditional Name: (Z)-2,3-bis(2-thienyl)acrylic acid [2-[N-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C21H16N2O3S2 MolecularWeight: 408.49334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16N2O3S2/c22-10-11-23(16-6-2-1-3-7-16)20(24)15-26-21(25)18(19-9-5-13-28-19)14-17-8-4-12-27-17/h1-9,12-14H,11,15H2/b18-14+