4-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-1,4-diazepan-1-yl]methyl]benzenecarboximidamide hydrochloride

Systemtic Name: 4-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-1,4-diazepan-1-yl]methyl]benzenecarboximidamide hydrochloride Openeye Name: 4-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-oxo-1,4-diazepan-1-yl]methyl]benzamidine hydrochloride CAS Name: 4-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-oxo-1,4-diazepan-1-yl]methyl]benzenecarboximidamide hydrochloride IUPAC Name: 4-[[4-(6-chloronaphthalen-2-yl)sulfonyl-2-oxo-1,4-diazepan-1-yl]methyl]benzenecarboximidamide hydrochloride Traditional Name: 4-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-keto-1,4-diazepan-1-yl]methyl]benzamidine hydrochloride Formula: C23H24Cl2N4O3S MolecularWeight: 507.43266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N(C1)CC2=CC=C(C=C2)C(=N)N)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl.Cl

Isomeric SMILES

C1CN(CC(=O)N(C1)CC2=CC=C(C=C2)C(=N)N)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl.Cl

InChI

InChI=1S/C23H23ClN4O3S.ClH/c24-20-8-6-19-13-21(9-7-18(19)12-20)32(30,31)28-11-1-10-27(22(29)15-28)14-16-2-4-17(5-3-16)23(25)26;/h2-9,12-13H,1,10-11,14-15H2,(H3,25,26);1H