2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-4-oxidanyl-pentanoic acid

Systemtic Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-4-oxidanyl-pentanoic acid Openeye Name: 4-hydroxy-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]pentanoic acid CAS Name: 4-hydroxy-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-[(6-methyl-1H-benzimidazol-2-yl)thio]pentanoic acid IUPAC Name: 4-hydroxy-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]pentanoic acid Traditional Name: 4-hydroxy-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-5-[(6-methyl-1H-benzimidazol-2-yl)thio]valeric acid Formula: C26H27N3O6S2 MolecularWeight: 541.63908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(CC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)OC)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(CC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)OC)O

InChI

InChI=1S/C26H27N3O6S2/c1-16-3-12-22-23(13-16)28-26(27-22)36-15-19(30)14-24(25(31)32)29-37(33,34)21-10-6-18(7-11-21)17-4-8-20(35-2)9-5-17/h3-13,19,24,29-30H,14-15H2,1-2H3,(H,27,28)(H,31,32)