methyl 5-methyl-4-phenyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-4-phenyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[3-(4-isopropylphenyl)prop-2-enoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-phenyl-2-[3-(4-propan-2-ylphenyl)prop-2-enoylamino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[(3-p-cumenylacryloyl)amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C25H25NO3S MolecularWeight: 419.5359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C=CC2=CC=C(C=C2)C(C)C)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C=CC2=CC=C(C=C2)C(C)C)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C25H25NO3S/c1-16(2)19-13-10-18(11-14-19)12-15-21(27)26-24-23(25(28)29-4)22(17(3)30-24)20-8-6-5-7-9-20/h5-16H,1-4H3,(H,26,27)