3-phenyl-3-[[4-(4-pyridin-4-ylphenyl)thiophen-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-phenyl-3-[[4-(4-pyridin-4-ylphenyl)thiophen-2-yl]carbonylamino]propanoic acid Openeye Name: 3-phenyl-3-[[4-[4-(4-pyridyl)phenyl]thiophene-2-carbonyl]amino]propanoic acid CAS Name: 3-[[oxo-[4-(4-pyridin-4-ylphenyl)-2-thiophenyl]methyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-3-[[4-(4-pyridin-4-ylphenyl)thiophene-2-carbonyl]amino]propanoic acid Traditional Name: 3-phenyl-3-[[4-[4-(4-pyridyl)phenyl]thiophene-2-carbonyl]amino]propionic acid Formula: C25H20N2O3S MolecularWeight: 428.5029

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=CS2)C3=CC=C(C=C3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=CS2)C3=CC=C(C=C3)C4=CC=NC=C4

InChI

InChI=1S/C25H20N2O3S/c28-24(29)15-22(20-4-2-1-3-5-20)27-25(30)23-14-21(16-31-23)18-8-6-17(7-9-18)19-10-12-26-13-11-19/h1-14,16,22H,15H2,(H,27,30)(H,28,29)