[2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl] 4-[2-(1-methylpyrrolidin-2-yl)ethylamino]benzenesulfonate

Systemtic Name: [2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl] 4-[2-(1-methylpyrrolidin-2-yl)ethylamino]benzenesulfonate Openeye Name: [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] 4-[2-(1-methylpyrrolidin-2-yl)ethylamino]benzenesulfonate CAS Name: 4-[2-(1-methyl-2-pyrrolidinyl)ethylamino]benzenesulfonic acid [2-[[cyclopropyl(oxo)methyl]amino]-3H-benzimidazol-5-yl] ester IUPAC Name: [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] 4-[2-(1-methylpyrrolidin-2-yl)ethylamino]benzenesulfonate Traditional Name: 4-[2-(1-methylpyrrolidin-2-yl)ethylamino]benzenesulfonic acid [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] ester Formula: C24H29N5O4S MolecularWeight: 483.58316

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1CCNC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)C5CC5

Isomeric SMILES

CN1CCCC1CCNC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)C5CC5

InChI

InChI=1S/C24H29N5O4S/c1-29-14-2-3-18(29)12-13-25-17-6-9-20(10-7-17)34(31,32)33-19-8-11-21-22(15-19)27-24(26-21)28-23(30)16-4-5-16/h6-11,15-16,18,25H,2-5,12-14H2,1H3,(H2,26,27,28,30)