ethyl 4-methyl-2-[[6-(3-methylbutyl)-4-oxidanylidene-1H-pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[6-(3-methylbutyl)-4-oxidanylidene-1H-pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(6-isopentyl-4-oxo-1H-pyrimidin-2-yl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[[6-(3-methylbutyl)-4-oxo-1H-pyrimidin-2-yl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[6-(3-methylbutyl)-4-oxo-1H-pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[(6-isoamyl-4-keto-1H-pyrimidin-2-yl)amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2=NC(=O)C=C(N2)CCC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2=NC(=O)C=C(N2)CCC(C)C)C

InChI

InChI=1S/C16H22N4O3S/c1-5-23-14(22)13-10(4)17-16(24-13)20-15-18-11(7-6-9(2)3)8-12(21)19-15/h8-9H,5-7H2,1-4H3,(H2,17,18,19,20,21)