[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(2-methylphenyl)-1-phenyl-pyrazole-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)COC(=O)C1=CN(N=C1C2=CC=CC=C2C)C3=CC=CC=C3

Isomeric SMILES

CCNC(=O)NC(=O)COC(=O)C1=CN(N=C1C2=CC=CC=C2C)C3=CC=CC=C3

InChI

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