[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 5-methyl-1-pyridin-2-yl-pyrazole-4-carboxylate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 5-methyl-1-pyridin-2-yl-pyrazole-4-carboxylate Openeye Name: (1-allophanoyl-2-methyl-propyl) 5-methyl-1-(2-pyridyl)pyrazole-4-carboxylate CAS Name: 5-methyl-1-(2-pyridinyl)-4-pyrazolecarboxylic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 5-methyl-1-pyridin-2-ylpyrazole-4-carboxylate Traditional Name: 5-methyl-1-(2-pyridyl)pyrazole-4-carboxylic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=N2)C(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=N2)C(=O)OC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C16H19N5O4/c1-9(2)13(14(22)20-16(17)24)25-15(23)11-8-19-21(10(11)3)12-6-4-5-7-18-12/h4-9,13H,1-3H3,(H3,17,20,22,24)