methyl 4-[[[2-(4-phenylphenyl)-3-thiophen-2-yl-prop-2-enoyl]amino]methyl]benzoate

Systemtic Name: methyl 4-[[[2-(4-phenylphenyl)-3-thiophen-2-yl-prop-2-enoyl]amino]methyl]benzoate Openeye Name: methyl 4-[[[2-(4-phenylphenyl)-3-(2-thienyl)prop-2-enoyl]amino]methyl]benzoate CAS Name: 4-[[[1-oxo-2-(4-phenylphenyl)-3-thiophen-2-ylprop-2-enyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(4-phenylphenyl)-3-thiophen-2-ylprop-2-enoyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(4-phenylphenyl)-3-(2-thienyl)acryloyl]amino]methyl]benzoic acid methyl ester Formula: C28H23NO3S MolecularWeight: 453.55212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C(=CC2=CC=CS2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C(=CC2=CC=CS2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H23NO3S/c1-32-28(31)24-11-9-20(10-12-24)19-29-27(30)26(18-25-8-5-17-33-25)23-15-13-22(14-16-23)21-6-3-2-4-7-21/h2-18H,19H2,1H3,(H,29,30)