ethyl 4-cyano-5-[[(E)-3-(3,4-diethoxyphenyl)prop-2-enoyl]amino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[[(E)-3-(3,4-diethoxyphenyl)prop-2-enoyl]amino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[[(E)-3-(3,4-diethoxyphenyl)prop-2-enoyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[(E)-3-(3,4-diethoxyphenyl)-1-oxoprop-2-enyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[[(E)-3-(3,4-diethoxyphenyl)prop-2-enoyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[(E)-3-(3,4-diethoxyphenyl)acryloyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N)OCC

InChI

InChI=1S/C22H24N2O5S/c1-5-27-17-10-8-15(12-18(17)28-6-2)9-11-19(25)24-21-16(13-23)14(4)20(30-21)22(26)29-7-3/h8-12H,5-7H2,1-4H3,(H,24,25)/b11-9+