[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 3-(2-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 3-(2-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: (2-oxo-2-ureido-ethyl) 1-benzyl-3-(2-methoxyphenyl)pyrazole-4-carboxylate CAS Name: 3-(2-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolecarboxylic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 1-benzyl-3-(2-methoxyphenyl)pyrazole-4-carboxylate Traditional Name: 1-benzyl-3-(2-methoxyphenyl)pyrazole-4-carboxylic acid (2-keto-2-ureido-ethyl) ester Formula: C21H20N4O5 MolecularWeight: 408.4073

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C=C2C(=O)OCC(=O)NC(=O)N)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C=C2C(=O)OCC(=O)NC(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C21H20N4O5/c1-29-17-10-6-5-9-15(17)19-16(20(27)30-13-18(26)23-21(22)28)12-25(24-19)11-14-7-3-2-4-8-14/h2-10,12H,11,13H2,1H3,(H3,22,23,26,28)