3-methyl-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide

Systemtic Name: 3-methyl-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide Openeye Name: 3-methyl-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide CAS Name: 3-methyl-N-[2-[[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy]ethyl]benzenesulfonamide IUPAC Name: 3-methyl-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide Traditional Name: 3-methyl-N-[2-[6-(4-methylpiperazino)pyrimidin-4-yl]oxyethyl]benzenesulfonamide Formula: C18H25N5O3S MolecularWeight: 391.4878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCN(CC3)C

InChI

InChI=1S/C18H25N5O3S/c1-15-4-3-5-16(12-15)27(24,25)21-6-11-26-18-13-17(19-14-20-18)23-9-7-22(2)8-10-23/h3-5,12-14,21H,6-11H2,1-2H3