4-[[5-[methyl(phenylsulfonyl)amino]-1-propyl-benzimidazol-2-yl]methyl]benzenecarboximidamide hydrochloride

Systemtic Name: 4-[[5-[methyl(phenylsulfonyl)amino]-1-propyl-benzimidazol-2-yl]methyl]benzenecarboximidamide hydrochloride Openeye Name: 4-[[5-[benzenesulfonyl(methyl)amino]-1-propyl-benzimidazol-2-yl]methyl]benzamidine hydrochloride CAS Name: 4-[[5-[benzenesulfonyl(methyl)amino]-1-propyl-2-benzimidazolyl]methyl]benzenecarboximidamide hydrochloride IUPAC Name: 4-[[5-[benzenesulfonyl(methyl)amino]-1-propylbenzimidazol-2-yl]methyl]benzenecarboximidamide hydrochloride Traditional Name: 4-[[5-[besyl(methyl)amino]-1-propyl-benzimidazol-2-yl]methyl]benzamidine hydrochloride Formula: C25H28ClN5O2S MolecularWeight: 498.04012

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)N(C)S(=O)(=O)C3=CC=CC=C3)N=C1CC4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)N(C)S(=O)(=O)C3=CC=CC=C3)N=C1CC4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C25H27N5O2S.ClH/c1-3-15-30-23-14-13-20(29(2)33(31,32)21-7-5-4-6-8-21)17-22(23)28-24(30)16-18-9-11-19(12-10-18)25(26)27;/h4-14,17H,3,15-16H2,1-2H3,(H3,26,27);1H