6-[6-[(4-methylphenyl)sulfonylamino]-2,3-diphenyl-benzimidazol-5-yl]oxyhexanoic acid

Systemtic Name: 6-[6-[(4-methylphenyl)sulfonylamino]-2,3-diphenyl-benzimidazol-5-yl]oxyhexanoic acid Openeye Name: 6-[2,3-diphenyl-6-(p-tolylsulfonylamino)benzimidazol-5-yl]oxyhexanoic acid CAS Name: 6-[[6-[(4-methylphenyl)sulfonylamino]-2,3-diphenyl-5-benzimidazolyl]oxy]hexanoic acid IUPAC Name: 6-[6-[(4-methylphenyl)sulfonylamino]-2,3-diphenylbenzimidazol-5-yl]oxyhexanoic acid Traditional Name: 6-[2,3-diphenyl-6-(tosylamino)benzimidazol-5-yl]oxyhexanoic acid Formula: C32H31N3O5S MolecularWeight: 569.67064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C3C(=C2)N=C(N3C4=CC=CC=C4)C5=CC=CC=C5)OCCCCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C3C(=C2)N=C(N3C4=CC=CC=C4)C5=CC=CC=C5)OCCCCCC(=O)O

InChI

InChI=1S/C32H31N3O5S/c1-23-16-18-26(19-17-23)41(38,39)34-28-21-27-29(22-30(28)40-20-10-4-9-15-31(36)37)35(25-13-7-3-8-14-25)32(33-27)24-11-5-2-6-12-24/h2-3,5-8,11-14,16-19,21-22,34H,4,9-10,15,20H2,1H3,(H,36,37)