N-[4-(1,4-diazepan-1-yl)-2-(methylsulfonylamino)phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-(1,4-diazepan-1-yl)-2-(methylsulfonylamino)phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-(1,4-diazepan-1-yl)-2-(methanesulfonamido)phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-(1,4-diazepan-1-yl)-2-(methanesulfonamido)phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-(1,4-diazepan-1-yl)-2-(methanesulfonamido)phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-(1,4-diazepan-1-yl)-2-(methanesulfonamido)phenyl]-4-methyl-benzenesulfonamide Formula: C19H26N4O4S2 MolecularWeight: 438.56414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)N3CCCNCC3)NS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)N3CCCNCC3)NS(=O)(=O)C

InChI

InChI=1S/C19H26N4O4S2/c1-15-4-7-17(8-5-15)29(26,27)22-18-9-6-16(14-19(18)21-28(2,24)25)23-12-3-10-20-11-13-23/h4-9,14,20-22H,3,10-13H2,1-2H3