3-azanyl-4-(1,4-diazepan-1-yl)-N-(4-propan-2-ylphenyl)benzenesulfonamide hydrochloride

Systemtic Name: 3-azanyl-4-(1,4-diazepan-1-yl)-N-(4-propan-2-ylphenyl)benzenesulfonamide hydrochloride Openeye Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-isopropylphenyl)benzenesulfonamide hydrochloride CAS Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-propan-2-ylphenyl)benzenesulfonamide hydrochloride IUPAC Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-propan-2-ylphenyl)benzenesulfonamide hydrochloride Traditional Name: 3-amino-4-(1,4-diazepan-1-yl)-N-p-cumenyl-benzenesulfonamide hydrochloride Formula: C20H29ClN4O2S MolecularWeight: 424.98786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O2S.ClH/c1-15(2)16-4-6-17(7-5-16)23-27(25,26)18-8-9-20(19(21)14-18)24-12-3-10-22-11-13-24;/h4-9,14-15,22-23H,3,10-13,21H2,1-2H3;1H