4-[[1-methyl-5-(pyridin-3-ylsulfonylamino)benzimidazol-2-yl]methyl]benzenecarboximidamide hydrochloride

Systemtic Name: 4-[[1-methyl-5-(pyridin-3-ylsulfonylamino)benzimidazol-2-yl]methyl]benzenecarboximidamide hydrochloride Openeye Name: 4-[[1-methyl-5-(3-pyridylsulfonylamino)benzimidazol-2-yl]methyl]benzamidine hydrochloride CAS Name: 4-[[1-methyl-5-(3-pyridinylsulfonylamino)-2-benzimidazolyl]methyl]benzenecarboximidamide hydrochloride IUPAC Name: 4-[[1-methyl-5-(pyridin-3-ylsulfonylamino)benzimidazol-2-yl]methyl]benzenecarboximidamide hydrochloride Traditional Name: 4-[[1-methyl-5-(3-pyridylsulfonylamino)benzimidazol-2-yl]methyl]benzamidine hydrochloride Formula: C21H21ClN6O2S MolecularWeight: 456.94844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CN=CC=C3)N=C1CC4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CN=CC=C3)N=C1CC4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C21H20N6O2S.ClH/c1-27-19-9-8-16(26-30(28,29)17-3-2-10-24-13-17)12-18(19)25-20(27)11-14-4-6-15(7-5-14)21(22)23;/h2-10,12-13,26H,11H2,1H3,(H3,22,23);1H