6-[(4-chlorophenyl)sulfonyl-[1-(4-methoxyphenyl)-2-phenyl-benzimidazol-5-yl]amino]hexanoic acid

Systemtic Name: 6-[(4-chlorophenyl)sulfonyl-[1-(4-methoxyphenyl)-2-phenyl-benzimidazol-5-yl]amino]hexanoic acid Openeye Name: 6-[(4-chlorophenyl)sulfonyl-[1-(4-methoxyphenyl)-2-phenyl-benzimidazol-5-yl]amino]hexanoic acid CAS Name: 6-[(4-chlorophenyl)sulfonyl-[1-(4-methoxyphenyl)-2-phenyl-5-benzimidazolyl]amino]hexanoic acid IUPAC Name: 6-[(4-chlorophenyl)sulfonyl-[1-(4-methoxyphenyl)-2-phenylbenzimidazol-5-yl]amino]hexanoic acid Traditional Name: 6-[(4-chlorophenyl)sulfonyl-[1-(4-methoxyphenyl)-2-phenyl-benzimidazol-5-yl]amino]hexanoic acid Formula: C32H30ClN3O5S MolecularWeight: 604.1157

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=C(C=C(C=C3)N(CCCCCC(=O)O)S(=O)(=O)C4=CC=C(C=C4)Cl)N=C2C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=C(C=C(C=C3)N(CCCCCC(=O)O)S(=O)(=O)C4=CC=C(C=C4)Cl)N=C2C5=CC=CC=C5

InChI

InChI=1S/C32H30ClN3O5S/c1-41-27-16-13-25(14-17-27)36-30-20-15-26(22-29(30)34-32(36)23-8-4-2-5-9-23)35(21-7-3-6-10-31(37)38)42(39,40)28-18-11-24(33)12-19-28/h2,4-5,8-9,11-20,22H,3,6-7,10,21H2,1H3,(H,37,38)