2-[[5-[[4-(4-phenylbutylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridin-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[5-[[4-(4-phenylbutylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridin-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[5-[[4-(4-phenylbutylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carbonyl]amino]acetic acid CAS Name: 2-[[oxo-[5-[oxo-[[4-[oxo-(4-phenylbutylamino)methyl]phenyl]sulfonylamino]methyl]-2-pyridinyl]methyl]amino]acetic acid IUPAC Name: 2-[[5-[[4-(4-phenylbutylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carbonyl]amino]acetic acid Traditional Name: 2-[[5-[[4-(4-phenylbutylcarbamoyl)phenyl]sulfonylcarbamoyl]picolinoyl]amino]acetic acid Formula: C26H26N4O7S MolecularWeight: 538.57224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCNC(=O)C2=CC=C(C=C2)S(=O)(=O)NC(=O)C3=CN=C(C=C3)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCNC(=O)C2=CC=C(C=C2)S(=O)(=O)NC(=O)C3=CN=C(C=C3)C(=O)NCC(=O)O

InChI

InChI=1S/C26H26N4O7S/c31-23(32)17-29-26(35)22-14-11-20(16-28-22)25(34)30-38(36,37)21-12-9-19(10-13-21)24(33)27-15-5-4-8-18-6-2-1-3-7-18/h1-3,6-7,9-14,16H,4-5,8,15,17H2,(H,27,33)(H,29,35)(H,30,34)(H,31,32)