6-[[4-[[2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]phenyl]amino]hexanoic acid

Systemtic Name: 6-[[4-[[2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]phenyl]amino]hexanoic acid Openeye Name: 6-[4-[[2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]hexanoic acid CAS Name: 6-[4-[[2-[[cyclopropyl(oxo)methyl]amino]-3H-benzimidazol-5-yl]oxysulfonyl]anilino]hexanoic acid IUPAC Name: 6-[4-[[2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]hexanoic acid Traditional Name: 6-[4-[[2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]hexanoic acid Formula: C23H26N4O6S MolecularWeight: 486.54074

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=NC3=C(N2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)NCCCCCC(=O)O

Isomeric SMILES

C1CC1C(=O)NC2=NC3=C(N2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)NCCCCCC(=O)O

InChI

InChI=1S/C23H26N4O6S/c28-21(29)4-2-1-3-13-24-16-7-10-18(11-8-16)34(31,32)33-17-9-12-19-20(14-17)26-23(25-19)27-22(30)15-5-6-15/h7-12,14-15,24H,1-6,13H2,(H,28,29)(H2,25,26,27,30)