[2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl] 4-[(1,3-dimethylpyrazol-4-yl)methylamino]benzenesulfonate

Systemtic Name: [2-(cyclopropylcarbonylamino)-3H-benzimidazol-5-yl] 4-[(1,3-dimethylpyrazol-4-yl)methylamino]benzenesulfonate Openeye Name: [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] 4-[(1,3-dimethylpyrazol-4-yl)methylamino]benzenesulfonate CAS Name: 4-[(1,3-dimethyl-4-pyrazolyl)methylamino]benzenesulfonic acid [2-[[cyclopropyl(oxo)methyl]amino]-3H-benzimidazol-5-yl] ester IUPAC Name: [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] 4-[(1,3-dimethylpyrazol-4-yl)methylamino]benzenesulfonate Traditional Name: 4-[(1,3-dimethylpyrazol-4-yl)methylamino]benzenesulfonic acid [2-(cyclopropanecarbonylamino)-3H-benzimidazol-5-yl] ester Formula: C23H24N6O4S MolecularWeight: 480.53946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)C5CC5)C

Isomeric SMILES

CC1=NN(C=C1CNC2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)C5CC5)C

InChI

InChI=1S/C23H24N6O4S/c1-14-16(13-29(2)28-14)12-24-17-5-8-19(9-6-17)34(31,32)33-18-7-10-20-21(11-18)26-23(25-20)27-22(30)15-3-4-15/h5-11,13,15,24H,3-4,12H2,1-2H3,(H2,25,26,27,30)