methyl 3-[[2-cyano-3-(4-cyanophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2-cyano-3-(4-cyanophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-cyano-3-(4-cyanophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-cyano-3-(4-cyanophenyl)-1-oxoprop-2-enyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-cyano-3-(4-cyanophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-cyano-3-(4-cyanophenyl)acryloyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C17H11N3O3S MolecularWeight: 337.35254

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C(=CC2=CC=C(C=C2)C#N)C#N

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C(=CC2=CC=C(C=C2)C#N)C#N

InChI

InChI=1S/C17H11N3O3S/c1-23-17(22)15-14(6-7-24-15)20-16(21)13(10-19)8-11-2-4-12(9-18)5-3-11/h2-8H,1H3,(H,20,21)