2-[1-(dimethylsulfamoyl)-4-methyl-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylate; propan-2-ylazanium

Systemtic Name: 2-[1-(dimethylsulfamoyl)-4-methyl-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylate; propan-2-ylazanium Openeye Name: 2-[1-(dimethylsulfamoyl)-4-methyl-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylate; isopropylammonium CAS Name: 2-[1-(dimethylsulfamoyl)-4-methyl-2-benzimidazolyl]-5-methyl-3-pyridinecarboxylate; propan-2-ylammonium IUPAC Name: 2-[1-(dimethylsulfamoyl)-4-methylbenzimidazol-2-yl]-5-methylpyridine-3-carboxylate; propan-2-ylazanium Traditional Name: 2-[1-(dimethylsulfamoyl)-4-methyl-benzimidazol-2-yl]-5-methyl-nicotinate; isopropylammonium Formula: C20H27N5O4S MolecularWeight: 433.52448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(C(=N2)C3=NC=C(C=C3C(=O)[O-])C)S(=O)(=O)N(C)C.CC(C)[NH3+]

Isomeric SMILES

CC1=C2C(=CC=C1)N(C(=N2)C3=NC=C(C=C3C(=O)[O-])C)S(=O)(=O)N(C)C.CC(C)[NH3+]

InChI

InChI=1S/C17H18N4O4S.C3H9N/c1-10-8-12(17(22)23)15(18-9-10)16-19-14-11(2)6-5-7-13(14)21(16)26(24,25)20(3)4;1-3(2)4/h5-9H,1-4H3,(H,22,23);3H,4H2,1-2H3