ethyl 2-[[(E)-2-cyano-3-(2,4-diethoxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-(2,4-diethoxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-2-cyano-3-(2,4-diethoxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-(2,4-diethoxyphenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-(2,4-diethoxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(2,4-diethoxyphenyl)acryloyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C=C(C#N)C(=O)NC2=C(C=CS2)C(=O)OCC)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C=CS2)C(=O)OCC)OCC

InChI

InChI=1S/C21H22N2O5S/c1-4-26-16-8-7-14(18(12-16)27-5-2)11-15(13-22)19(24)23-20-17(9-10-29-20)21(25)28-6-3/h7-12H,4-6H2,1-3H3,(H,23,24)/b15-11+