3-(4-chlorophenyl)-2-[2-oxidanylidene-3-[(4-phenylphenyl)carbonylamino]-5-thiophen-2-yl-pyridin-1-yl]propanoic acid

Systemtic Name: 3-(4-chlorophenyl)-2-[2-oxidanylidene-3-[(4-phenylphenyl)carbonylamino]-5-thiophen-2-yl-pyridin-1-yl]propanoic acid Openeye Name: 3-(4-chlorophenyl)-2-[2-oxo-3-[(4-phenylbenzoyl)amino]-5-(2-thienyl)-1-pyridyl]propanoic acid CAS Name: 3-(4-chlorophenyl)-2-[2-oxo-3-[[oxo-(4-phenylphenyl)methyl]amino]-5-thiophen-2-yl-1-pyridinyl]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-2-[2-oxo-3-[(4-phenylbenzoyl)amino]-5-thiophen-2-ylpyridin-1-yl]propanoic acid Traditional Name: 3-(4-chlorophenyl)-2-[2-keto-3-[(4-phenylbenzoyl)amino]-5-(2-thienyl)-1-pyridyl]propionic acid Formula: C31H23ClN2O4S MolecularWeight: 555.04332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=CN(C3=O)C(CC4=CC=C(C=C4)Cl)C(=O)O)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=CN(C3=O)C(CC4=CC=C(C=C4)Cl)C(=O)O)C5=CC=CS5

InChI

InChI=1S/C31H23ClN2O4S/c32-25-14-8-20(9-15-25)17-27(31(37)38)34-19-24(28-7-4-16-39-28)18-26(30(34)36)33-29(35)23-12-10-22(11-13-23)21-5-2-1-3-6-21/h1-16,18-19,27H,17H2,(H,33,35)(H,37,38)