3-(aminocarbonylamino)-2-[(4-chlorophenyl)sulfonylamino]-2-(4-phenylphenyl)-5-pyridin-2-yl-pentanoic acid

Systemtic Name: 3-(aminocarbonylamino)-2-[(4-chlorophenyl)sulfonylamino]-2-(4-phenylphenyl)-5-pyridin-2-yl-pentanoic acid Openeye Name: 2-[(4-chlorophenyl)sulfonylamino]-2-(4-phenylphenyl)-5-(2-pyridyl)-3-ureido-pentanoic acid CAS Name: 3-(carbamoylamino)-2-[(4-chlorophenyl)sulfonylamino]-2-(4-phenylphenyl)-5-(2-pyridinyl)pentanoic acid IUPAC Name: 3-(carbamoylamino)-2-[(4-chlorophenyl)sulfonylamino]-2-(4-phenylphenyl)-5-pyridin-2-ylpentanoic acid Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]-2-(4-phenylphenyl)-5-(2-pyridyl)-3-ureido-valeric acid Formula: C29H27ClN4O5S MolecularWeight: 579.06648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(C(CCC3=CC=CC=N3)NC(=O)N)(C(=O)O)NS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(C(CCC3=CC=CC=N3)NC(=O)N)(C(=O)O)NS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H27ClN4O5S/c30-23-13-16-25(17-14-23)40(38,39)34-29(27(35)36,22-11-9-21(10-12-22)20-6-2-1-3-7-20)26(33-28(31)37)18-15-24-8-4-5-19-32-24/h1-14,16-17,19,26,34H,15,18H2,(H,35,36)(H3,31,33,37)