1-[3-[2-azanyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]phenyl]ethanone

Systemtic Name: 1-[3-[2-azanyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]phenyl]ethanone Openeye Name: 1-[3-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]phenyl]ethanone CAS Name: 1-[3-[2-amino-6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]phenyl]ethanone IUPAC Name: 1-[3-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]phenyl]ethanone Traditional Name: 1-[3-[2-amino-6-(4-methylpiperazino)pyrimidin-4-yl]phenyl]ethanone Formula: C17H21N5O MolecularWeight: 311.38154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC(=C1)C2=CC(=NC(=N2)N)N3CCN(CC3)C

Isomeric SMILES

CC(=O)C1=CC=CC(=C1)C2=CC(=NC(=N2)N)N3CCN(CC3)C

InChI

InChI=1S/C17H21N5O/c1-12(23)13-4-3-5-14(10-13)15-11-16(20-17(18)19-15)22-8-6-21(2)7-9-22/h3-5,10-11H,6-9H2,1-2H3,(H2,18,19,20)