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

Systemtic Name: 3-[[4-[[2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]phenyl]amino]-3-phenyl-propanoic acid Openeye Name: 3-[4-[[2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]-3-phenyl-propanoic acid CAS Name: 3-[4-[[2-[[cyclopropyl(oxo)methyl]amino]-3H-benzimidazol-5-yl]oxysulfonyl]anilino]-3-phenylpropanoic acid IUPAC Name: 3-[4-[[2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]-3-phenylpropanoic acid Traditional Name: 3-[4-[[2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl]oxysulfonyl]anilino]-3-phenyl-propionic acid Formula: C26H24N4O6S MolecularWeight: 520.55696

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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)NC(CC(=O)O)C5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)NC2=NC3=C(N2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)NC(CC(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C26H24N4O6S/c31-24(32)15-22(16-4-2-1-3-5-16)27-18-8-11-20(12-9-18)37(34,35)36-19-10-13-21-23(14-19)29-26(28-21)30-25(33)17-6-7-17/h1-5,8-14,17,22,27H,6-7,15H2,(H,31,32)(H2,28,29,30,33)