3-azanyl-4-(1,4-diazepan-1-yl)-N-(2,5-dimethylphenyl)benzenesulfonamide

Systemtic Name: 3-azanyl-4-(1,4-diazepan-1-yl)-N-(2,5-dimethylphenyl)benzenesulfonamide Openeye Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(2,5-dimethylphenyl)benzenesulfonamide CAS Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(2,5-dimethylphenyl)benzenesulfonamide IUPAC Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(2,5-dimethylphenyl)benzenesulfonamide Traditional Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(2,5-dimethylphenyl)benzenesulfonamide Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCNCC3)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)NS(=O)(=O)C2=CC(=C(C=C2)N3CCCNCC3)N

InChI

InChI=1S/C19H26N4O2S/c1-14-4-5-15(2)18(12-14)22-26(24,25)16-6-7-19(17(20)13-16)23-10-3-8-21-9-11-23/h4-7,12-13,21-22H,3,8-11,20H2,1-2H3