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

Systemtic Name: N-[4-(1,4-diazepan-1-yl)-2-(phenylsulfonylamino)phenyl]-4-methyl-benzenesulfonamide hydrochloride Openeye Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-4-methyl-benzenesulfonamide hydrochloride CAS Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-4-methylbenzenesulfonamide hydrochloride IUPAC Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-4-methylbenzenesulfonamide hydrochloride Traditional Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-4-methyl-benzenesulfonamide hydrochloride Formula: C24H29ClN4O4S2 MolecularWeight: 537.09446

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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)C4=CC=CC=C4.Cl

Isomeric SMILES

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

InChI

InChI=1S/C24H28N4O4S2.ClH/c1-19-8-11-22(12-9-19)34(31,32)26-23-13-10-20(28-16-5-14-25-15-17-28)18-24(23)27-33(29,30)21-6-3-2-4-7-21;/h2-4,6-13,18,25-27H,5,14-17H2,1H3;1H