methyl 3-[3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]-4-methyl-benzoate CAS Name: 3-[[3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-1-oxopropyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]-4-methylbenzoate Traditional Name: 3-[3-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)propanoylamino]-4-methyl-benzoic acid methyl ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=C(NC(=NC2=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=C(NC(=NC2=O)C)C

InChI

InChI=1S/C18H21N3O4/c1-10-5-6-13(18(24)25-4)9-15(10)21-16(22)8-7-14-11(2)19-12(3)20-17(14)23/h5-6,9H,7-8H2,1-4H3,(H,21,22)(H,19,20,23)