[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolecarboxylic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-(2-chlorobenzyl)-3,5-dimethyl-pyrazole-4-carboxylic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C19H23ClN4O4 MolecularWeight: 406.86332

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1=C(N(N=C1C)CC2=CC=CC=C2Cl)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1=C(N(N=C1C)CC2=CC=CC=C2Cl)C

InChI

InChI=1S/C19H23ClN4O4/c1-4-9-21-19(27)22-16(25)11-28-18(26)17-12(2)23-24(13(17)3)10-14-7-5-6-8-15(14)20/h5-8H,4,9-11H2,1-3H3,(H2,21,22,25,27)