[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] 3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolecarboxylic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] 3-(3,4-dimethylphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(3,4-dimethylphenyl)-1-phenyl-pyrazole-4-carboxylic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C22H22N4O4 MolecularWeight: 406.43448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)OCC(=O)NC(=O)NC)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)OCC(=O)NC(=O)NC)C3=CC=CC=C3)C

InChI

InChI=1S/C22H22N4O4/c1-14-9-10-16(11-15(14)2)20-18(12-26(25-20)17-7-5-4-6-8-17)21(28)30-13-19(27)24-22(29)23-3/h4-12H,13H2,1-3H3,(H2,23,24,27,29)