4-(3-methyl-4-methylsulfanyl-phenoxy)-3-[(4-pyridin-4-ylpiperazin-1-yl)methyl]benzenesulfonamide

Systemtic Name: 4-(3-methyl-4-methylsulfanyl-phenoxy)-3-[(4-pyridin-4-ylpiperazin-1-yl)methyl]benzenesulfonamide Openeye Name: 4-(3-methyl-4-methylsulfanyl-phenoxy)-3-[[4-(4-pyridyl)piperazin-1-yl]methyl]benzenesulfonamide CAS Name: 4-[3-methyl-4-(methylthio)phenoxy]-3-[(4-pyridin-4-yl-1-piperazinyl)methyl]benzenesulfonamide IUPAC Name: 4-(3-methyl-4-methylsulfanylphenoxy)-3-[(4-pyridin-4-ylpiperazin-1-yl)methyl]benzenesulfonamide Traditional Name: 4-[3-methyl-4-(methylthio)phenoxy]-3-[[4-(4-pyridyl)piperazino]methyl]benzenesulfonamide Formula: C24H28N4O3S2 MolecularWeight: 484.63412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)N)CN3CCN(CC3)C4=CC=NC=C4)SC

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)N)CN3CCN(CC3)C4=CC=NC=C4)SC

InChI

InChI=1S/C24H28N4O3S2/c1-18-15-21(3-6-24(18)32-2)31-23-5-4-22(33(25,29)30)16-19(23)17-27-11-13-28(14-12-27)20-7-9-26-10-8-20/h3-10,15-16H,11-14,17H2,1-2H3,(H2,25,29,30)