2-(4-methylphenyl)carbonyl-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzamide

Systemtic Name: 2-(4-methylphenyl)carbonyl-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzamide Openeye Name: 2-(4-methylbenzoyl)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzamide CAS Name: 2-[(4-methylphenyl)-oxomethyl]-N-[2-[[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy]ethyl]benzamide IUPAC Name: 2-(4-methylbenzoyl)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]benzamide Traditional Name: N-[2-[6-(4-methylpiperazino)pyrimidin-4-yl]oxyethyl]-2-p-toluoyl-benzamide Formula: C26H29N5O3 MolecularWeight: 459.54016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCCOC3=NC=NC(=C3)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCCOC3=NC=NC(=C3)N4CCN(CC4)C

InChI

InChI=1S/C26H29N5O3/c1-19-7-9-20(10-8-19)25(32)21-5-3-4-6-22(21)26(33)27-11-16-34-24-17-23(28-18-29-24)31-14-12-30(2)13-15-31/h3-10,17-18H,11-16H2,1-2H3,(H,27,33)