3-azanyl-4-(1,4-diazepan-1-yl)-N-(4-methoxyphenyl)benzenesulfonamide hydrochloride

Systemtic Name: 3-azanyl-4-(1,4-diazepan-1-yl)-N-(4-methoxyphenyl)benzenesulfonamide hydrochloride Openeye Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-methoxyphenyl)benzenesulfonamide hydrochloride CAS Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-methoxyphenyl)benzenesulfonamide hydrochloride IUPAC Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-methoxyphenyl)benzenesulfonamide hydrochloride Traditional Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-methoxyphenyl)benzenesulfonamide hydrochloride Formula: C18H25ClN4O3S MolecularWeight: 412.9341

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCNCC3)N.Cl

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCNCC3)N.Cl

InChI

InChI=1S/C18H24N4O3S.ClH/c1-25-15-5-3-14(4-6-15)21-26(23,24)16-7-8-18(17(19)13-16)22-11-2-9-20-10-12-22;/h3-8,13,20-21H,2,9-12,19H2,1H3;1H