2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-5-(quinolin-6-ylcarbonylamino)pentanoic acid

Systemtic Name: 2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-5-(quinolin-6-ylcarbonylamino)pentanoic acid Openeye Name: 2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-5-(quinoline-6-carbonylamino)pentanoic acid CAS Name: 2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-5-[[oxo(6-quinolinyl)methyl]amino]pentanoic acid IUPAC Name: 2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-5-(quinoline-6-carbonylamino)pentanoic acid Traditional Name: 2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-5-(quinoline-6-carbonylamino)valeric acid Formula: C27H24ClN3O5S MolecularWeight: 538.01456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)C(=O)NCCCC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)C(=O)NCCCC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl)N=C1

InChI

InChI=1S/C27H24ClN3O5S/c28-22-10-5-18(6-11-22)19-7-12-23(13-8-19)37(35,36)31-25(27(33)34)4-2-16-30-26(32)21-9-14-24-20(17-21)3-1-15-29-24/h1,3,5-15,17,25,31H,2,4,16H2,(H,30,32)(H,33,34)