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

Systemtic Name: 4-ethoxy-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide Openeye Name: 4-ethoxy-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide CAS Name: 4-ethoxy-N-[2-[[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy]ethyl]benzenesulfonamide IUPAC Name: 4-ethoxy-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide Traditional Name: 4-ethoxy-N-[2-[6-(4-methylpiperazino)pyrimidin-4-yl]oxyethyl]benzenesulfonamide Formula: C19H27N5O4S MolecularWeight: 421.51378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCN(CC3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCOC2=NC=NC(=C2)N3CCN(CC3)C

InChI

InChI=1S/C19H27N5O4S/c1-3-27-16-4-6-17(7-5-16)29(25,26)22-8-13-28-19-14-18(20-15-21-19)24-11-9-23(2)10-12-24/h4-7,14-15,22H,3,8-13H2,1-2H3