N-[4-(1,4-diazepan-1-yl)-2-(phenylsulfonylamino)phenyl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[4-(1,4-diazepan-1-yl)-2-(phenylsulfonylamino)phenyl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C26H32N4O4S2 MolecularWeight: 528.68668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2=C(C=C(C=C2)N3CCCNCC3)NS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2=C(C=C(C=C2)N3CCCNCC3)NS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C26H32N4O4S2/c1-19-16-20(2)26(21(3)17-19)36(33,34)28-24-11-10-22(30-14-7-12-27-13-15-30)18-25(24)29-35(31,32)23-8-5-4-6-9-23/h4-6,8-11,16-18,27-29H,7,12-15H2,1-3H3