propan-2-yl 4-cyano-5-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: propan-2-yl 4-cyano-5-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-3-methyl-thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-5-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]-3-methyl-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-5-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[(E)-3-(3,4-dimethoxyphenyl)acryloyl]amino]-3-methyl-thiophene-2-carboxylic acid isopropyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C=CC2=CC(=C(C=C2)OC)OC)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)/C=C/C2=CC(=C(C=C2)OC)OC)C(=O)OC(C)C

InChI

InChI=1S/C21H22N2O5S/c1-12(2)28-21(25)19-13(3)15(11-22)20(29-19)23-18(24)9-7-14-6-8-16(26-4)17(10-14)27-5/h6-10,12H,1-5H3,(H,23,24)/b9-7+