2-(2-tert-butyl-4-methyl-phenoxy)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]propanamide

Systemtic Name: 2-(2-tert-butyl-4-methyl-phenoxy)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]propanamide Openeye Name: 2-(2-tert-butyl-4-methyl-phenoxy)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]propanamide CAS Name: 2-(2-tert-butyl-4-methylphenoxy)-N-[2-[[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy]ethyl]propanamide IUPAC Name: 2-(2-tert-butyl-4-methylphenoxy)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]propanamide Traditional Name: 2-(2-tert-butyl-4-methyl-phenoxy)-N-[2-[6-(4-methylpiperazino)pyrimidin-4-yl]oxyethyl]propionamide Formula: C25H37N5O3 MolecularWeight: 455.59298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H37N5O3/c1-18-7-8-21(20(15-18)25(3,4)5)33-19(2)24(31)26-9-14-32-23-16-22(27-17-28-23)30-12-10-29(6)11-13-30/h7-8,15-17,19H,9-14H2,1-6H3,(H,26,31)