[2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl] 4-[2-(2-hydroxyethyloxy)ethylamino]benzenesulfonate

Systemtic Name: [2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl] 4-[2-(2-hydroxyethyloxy)ethylamino]benzenesulfonate Openeye Name: [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] 4-[2-(2-hydroxyethoxy)ethylamino]benzenesulfonate CAS Name: 4-[2-(2-hydroxyethoxy)ethylamino]benzenesulfonic acid [2-[[cyclopropyl(oxo)methyl]amino]-3H-benzimidazol-5-yl] ester IUPAC Name: [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] 4-[2-(2-hydroxyethoxy)ethylamino]benzenesulfonate Traditional Name: 4-[2-(2-hydroxyethoxy)ethylamino]benzenesulfonic acid [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] ester Formula: C21H24N4O6S MolecularWeight: 460.50346

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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)NCCOCCO

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O6S/c26-10-12-30-11-9-22-15-3-6-17(7-4-15)32(28,29)31-16-5-8-18-19(13-16)24-21(23-18)25-20(27)14-1-2-14/h3-8,13-14,22,26H,1-2,9-12H2,(H2,23,24,25,27)