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

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-[3-(phenylcarbonyloxy)phenyl]prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-3-(3-benzoyloxyphenyl)-2-cyano-prop-2-enoyl]amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(3-benzoyloxyphenyl)-2-cyano-1-oxoprop-2-enyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-(3-benzoyloxyphenyl)-2-cyanoprop-2-enoyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(3-benzoyloxyphenyl)-2-cyano-acryloyl]amino]-5-isopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H24N2O5S MolecularWeight: 488.55486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)C(=CC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)/C(=C/C2=CC(=CC=C2)OC(=O)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C27H24N2O5S/c1-4-33-27(32)22-15-23(17(2)3)35-25(22)29-24(30)20(16-28)13-18-9-8-12-21(14-18)34-26(31)19-10-6-5-7-11-19/h5-15,17H,4H2,1-3H3,(H,29,30)/b20-13+