ethyl 1-(2-oxidanyl-2-phenyl-ethyl)-5-(phenylcarbamoylamino)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(2-oxidanyl-2-phenyl-ethyl)-5-(phenylcarbamoylamino)pyrazole-4-carboxylate Openeye Name: ethyl 1-(2-hydroxy-2-phenyl-ethyl)-5-(phenylcarbamoylamino)pyrazole-4-carboxylate CAS Name: 5-[[anilino(oxo)methyl]amino]-1-(2-hydroxy-2-phenylethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-hydroxy-2-phenylethyl)-5-(phenylcarbamoylamino)pyrazole-4-carboxylate Traditional Name: 1-(2-hydroxy-2-phenyl-ethyl)-5-(phenylcarbamoylamino)pyrazole-4-carboxylic acid ethyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CC(C2=CC=CC=C2)O)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CC(C2=CC=CC=C2)O)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O4/c1-2-29-20(27)17-13-22-25(14-18(26)15-9-5-3-6-10-15)19(17)24-21(28)23-16-11-7-4-8-12-16/h3-13,18,26H,2,14H2,1H3,(H2,23,24,28)