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

Systemtic Name: 3-azanyl-4-(1,4-diazepan-1-yl)-N-(4-propan-2-ylphenyl)benzenesulfonamide Openeye Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-isopropylphenyl)benzenesulfonamide CAS Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-propan-2-ylphenyl)benzenesulfonamide IUPAC Name: 3-amino-4-(1,4-diazepan-1-yl)-N-(4-propan-2-ylphenyl)benzenesulfonamide Traditional Name: 3-amino-4-(1,4-diazepan-1-yl)-N-p-cumenyl-benzenesulfonamide Formula: C20H28N4O2S MolecularWeight: 388.52692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O2S/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