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

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] (Z)-2,3-bis(2-thienyl)prop-2-enoate CAS Name: (Z)-2,3-dithiophen-2-yl-2-propenoic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] (Z)-2,3-dithiophen-2-ylprop-2-enoate Traditional Name: (Z)-2,3-bis(2-thienyl)acrylic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C21H19NO3S2 MolecularWeight: 397.51046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C(=CC2=CC=CS2)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)/C(=C/C2=CC=CS2)/C3=CC=CS3)C

InChI

InChI=1S/C21H19NO3S2/c1-14-7-8-16(11-15(14)2)22-20(23)13-25-21(24)18(19-6-4-10-27-19)12-17-5-3-9-26-17/h3-12H,13H2,1-2H3,(H,22,23)/b18-12+