methyl 2-[(5-butyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-cyano-amino]ethanoate

Systemtic Name: methyl 2-[(5-butyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-cyano-amino]ethanoate Openeye Name: methyl 2-[(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-cyano-amino]acetate CAS Name: 2-[(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-cyanoamino]acetic acid methyl ester IUPAC Name: methyl 2-[(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-cyanoamino]acetate Traditional Name: 2-[(5-butyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-cyano-amino]acetic acid methyl ester Formula: C13H18N4O3 MolecularWeight: 278.30702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=NC1=O)N(CC(=O)OC)C#N)C

Isomeric SMILES

CCCCC1=C(NC(=NC1=O)N(CC(=O)OC)C#N)C

InChI

InChI=1S/C13H18N4O3/c1-4-5-6-10-9(2)15-13(16-12(10)19)17(8-14)7-11(18)20-3/h4-7H2,1-3H3,(H,15,16,19)