ethyl 2-[[(E)-2-cyano-3-[4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-[4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-2-cyano-3-(4-isobutoxyphenyl)prop-2-enoyl]amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-[4-(2-methylpropoxy)phenyl]-1-oxoprop-2-enyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-[4-(2-methylpropoxy)phenyl]prop-2-enoyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(4-isobutoxyphenyl)acryloyl]amino]-5-isopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)C(=CC2=CC=C(C=C2)OCC(C)C)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)/C(=C/C2=CC=C(C=C2)OCC(C)C)/C#N

InChI

InChI=1S/C24H28N2O4S/c1-6-29-24(28)20-12-21(16(4)5)31-23(20)26-22(27)18(13-25)11-17-7-9-19(10-8-17)30-14-15(2)3/h7-12,15-16H,6,14H2,1-5H3,(H,26,27)/b18-11+