ethyl 4-(5-hexyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(5-hexyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(5-hexyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)piperazine-1-carboxylate CAS Name: 4-(5-hexyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-hexyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(5-hexyl-4-keto-6-methyl-1H-pyrimidin-2-yl)piperazine-1-carboxylic acid ethyl ester Formula: C18H30N4O3 MolecularWeight: 350.4558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(NC(=NC1=O)N2CCN(CC2)C(=O)OCC)C

Isomeric SMILES

CCCCCCC1=C(NC(=NC1=O)N2CCN(CC2)C(=O)OCC)C

InChI

InChI=1S/C18H30N4O3/c1-4-6-7-8-9-15-14(3)19-17(20-16(15)23)21-10-12-22(13-11-21)18(24)25-5-2/h4-13H2,1-3H3,(H,19,20,23)