methyl 2-[[(E)-2-cyano-3-[3-methoxy-4-(phenylcarbonyloxy)phenyl]prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-[3-methoxy-4-(phenylcarbonyloxy)phenyl]prop-2-enoyl]amino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-3-(4-benzoyloxy-3-methoxy-phenyl)-2-cyano-prop-2-enoyl]amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-3-(4-benzoyloxy-3-methoxyphenyl)-2-cyano-1-oxoprop-2-enyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(4-benzoyloxy-3-methoxyphenyl)-2-cyanoprop-2-enoyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(4-benzoyloxy-3-methoxy-phenyl)-2-cyano-acryloyl]amino]-5-isopropyl-thiophene-3-carboxylic acid methyl ester Formula: C27H24N2O6S MolecularWeight: 504.55426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC)C#N)C(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C(S1)NC(=O)/C(=C/C2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC)/C#N)C(=O)OC

InChI

InChI=1S/C27H24N2O6S/c1-16(2)23-14-20(27(32)34-4)25(36-23)29-24(30)19(15-28)12-17-10-11-21(22(13-17)33-3)35-26(31)18-8-6-5-7-9-18/h5-14,16H,1-4H3,(H,29,30)/b19-12+