ethyl 2-[2-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: ethyl 2-[2-(4-methylpiperazin-1-yl)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: ethyl 2-[2-(4-methylpiperazin-1-yl)-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-(4-methyl-1-piperazinyl)-4-oxo-1H-pyrimidin-6-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-methylpiperazin-1-yl)-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-(4-methylpiperazino)-1H-pyrimidin-6-yl]acetic acid ethyl ester Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC(=O)N=C(N1)N2CCN(CC2)C

Isomeric SMILES

CCOC(=O)CC1=CC(=O)N=C(N1)N2CCN(CC2)C

InChI

InChI=1S/C13H20N4O3/c1-3-20-12(19)9-10-8-11(18)15-13(14-10)17-6-4-16(2)5-7-17/h8H,3-7,9H2,1-2H3,(H,14,15,18)