ethyl 4-methyl-6-(2-methylpropanoylamino)-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-6-(2-methylpropanoylamino)-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-methyl-6-(2-methylpropanoylamino)-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-[(2-methyl-1-oxopropyl)amino]-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-6-(2-methylpropanoylamino)-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(isobutyrylamino)-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1NC(=O)C(C)C)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1NC(=O)C(C)C)C2=CC=CC=C2)C

InChI

InChI=1S/C18H21N3O3/c1-5-24-18(23)14-12(4)19-15(13-9-7-6-8-10-13)20-16(14)21-17(22)11(2)3/h6-11H,5H2,1-4H3,(H,19,20,21,22)