methyl 2-[[(E)-2-cyano-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]amino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]amino]-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-3-(4-allyloxy-3-methoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-(3-methoxy-4-prop-2-enoxyphenyl)-1-oxoprop-2-enyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(4-allyloxy-3-methoxy-phenyl)-2-cyano-acryloyl]amino]-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C26H22N2O5S MolecularWeight: 474.52828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OC)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OC)OCC=C

InChI

InChI=1S/C26H22N2O5S/c1-4-12-33-21-11-10-17(14-22(21)31-2)13-19(16-27)24(29)28-25-20(26(30)32-3)15-23(34-25)18-8-6-5-7-9-18/h4-11,13-15H,1,12H2,2-3H3,(H,28,29)/b19-13+