2-(3,5-dimethylphenoxy)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]propanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]propanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]propanamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[2-[[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy]ethyl]propanamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]propanamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-[2-[6-(4-methylpiperazino)pyrimidin-4-yl]oxyethyl]propionamide Formula: C22H31N5O3 MolecularWeight: 413.51324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N5O3/c1-16-11-17(2)13-19(12-16)30-18(3)22(28)23-5-10-29-21-14-20(24-15-25-21)27-8-6-26(4)7-9-27/h11-15,18H,5-10H2,1-4H3,(H,23,28)