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

Systemtic Name: [2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl] 4-(4-methylpiperidin-1-yl)benzenesulfonate Openeye Name: [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] 4-(4-methyl-1-piperidyl)benzenesulfonate CAS Name: 4-(4-methyl-1-piperidinyl)benzenesulfonic acid [2-[[cyclopropyl(oxo)methyl]amino]-3H-benzimidazol-5-yl] ester IUPAC Name: [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] 4-(4-methylpiperidin-1-yl)benzenesulfonate Traditional Name: 4-(4-methylpiperidino)benzenesulfonic acid [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] ester Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)C5CC5

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)C5CC5

InChI

InChI=1S/C23H26N4O4S/c1-15-10-12-27(13-11-15)17-4-7-19(8-5-17)32(29,30)31-18-6-9-20-21(14-18)25-23(24-20)26-22(28)16-2-3-16/h4-9,14-16H,2-3,10-13H2,1H3,(H2,24,25,26,28)