methyl 2-[[5-methyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]carbamoyl]benzoate

Systemtic Name: methyl 2-[[5-methyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]carbamoyl]benzoate Openeye Name: methyl 2-[[5-methyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]carbamoyl]benzoate CAS Name: 2-[[[5-methyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[5-methyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]carbamoyl]benzoate Traditional Name: 2-[[2-(4-keto-6-methyl-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]carbamoyl]benzoic acid methyl ester Formula: C18H17N5O4 MolecularWeight: 367.35868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C)NC(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C)NC(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C18H17N5O4/c1-10-9-15(24)21-18(19-10)23-14(8-11(2)22-23)20-16(25)12-6-4-5-7-13(12)17(26)27-3/h4-9H,1-3H3,(H,20,25)(H,19,21,24)