3,4-diethoxy-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzamide

Systemtic Name: 3,4-diethoxy-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzamide Openeye Name: 3,4-diethoxy-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzamide CAS Name: 3,4-diethoxy-N-[2-[[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy]ethyl]benzamide IUPAC Name: 3,4-diethoxy-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzamide Traditional Name: 3,4-diethoxy-N-[2-[6-(4-methylpiperazino)pyrimidin-4-yl]oxyethyl]benzamide Formula: C22H31N5O4 MolecularWeight: 429.51264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N5O4/c1-4-29-18-7-6-17(14-19(18)30-5-2)22(28)23-8-13-31-21-15-20(24-16-25-21)27-11-9-26(3)10-12-27/h6-7,14-16H,4-5,8-13H2,1-3H3,(H,23,28)