methyl 4-(4-ethoxyphenyl)-5-methyl-2-[3-(4-phenylmethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethoxyphenyl)-5-methyl-2-[3-(4-phenylmethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[3-(4-benzyloxyphenyl)prop-2-enoylamino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-5-methyl-2-[[1-oxo-3-(4-phenylmethoxyphenyl)prop-2-enyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethoxyphenyl)-5-methyl-2-[3-(4-phenylmethoxyphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 2-[[3-(4-benzoxyphenyl)acryloyl]amino]-5-methyl-4-p-phenetyl-thiophene-3-carboxylic acid methyl ester Formula: C31H29NO5S MolecularWeight: 527.63066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C=CC3=CC=C(C=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C=CC3=CC=C(C=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C31H29NO5S/c1-4-36-25-17-13-24(14-18-25)28-21(2)38-30(29(28)31(34)35-3)32-27(33)19-12-22-10-15-26(16-11-22)37-20-23-8-6-5-7-9-23/h5-19H,4,20H2,1-3H3,(H,32,33)