3-(diethylsulfamoyl)-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]benzamide

Systemtic Name: 3-(diethylsulfamoyl)-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]benzamide Openeye Name: 3-(diethylsulfamoyl)-N-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]methyl]benzamide CAS Name: 3-(diethylsulfamoyl)-N-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]methyl]benzamide IUPAC Name: 3-(diethylsulfamoyl)-N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]benzamide Traditional Name: 3-(diethylsulfamoyl)-N-[[6-(4-methylpiperazino)-3-pyridyl]methyl]benzamide Formula: C22H31N5O3S MolecularWeight: 445.57824

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NCC2=CN=C(C=C2)N3CCN(CC3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NCC2=CN=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C22H31N5O3S/c1-4-27(5-2)31(29,30)20-8-6-7-19(15-20)22(28)24-17-18-9-10-21(23-16-18)26-13-11-25(3)12-14-26/h6-10,15-16H,4-5,11-14,17H2,1-3H3,(H,24,28)