4-(1,4-diazepan-1-yl)-1-(phenylsulfonyl)benzimidazole hydrochloride

Systemtic Name: 4-(1,4-diazepan-1-yl)-1-(phenylsulfonyl)benzimidazole hydrochloride Openeye Name: 1-(benzenesulfonyl)-4-(1,4-diazepan-1-yl)benzimidazole hydrochloride CAS Name: 1-(benzenesulfonyl)-4-(1,4-diazepan-1-yl)benzimidazole hydrochloride IUPAC Name: 1-(benzenesulfonyl)-4-(1,4-diazepan-1-yl)benzimidazole hydrochloride Traditional Name: 1-besyl-4-(1,4-diazepan-1-yl)benzimidazole hydrochloride Formula: C18H21ClN4O2S MolecularWeight: 392.90294

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC=CC3=C2N=CN3S(=O)(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CNCCN(C1)C2=CC=CC3=C2N=CN3S(=O)(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C18H20N4O2S.ClH/c23-25(24,15-6-2-1-3-7-15)22-14-20-18-16(8-4-9-17(18)22)21-12-5-10-19-11-13-21;/h1-4,6-9,14,19H,5,10-13H2;1H