ethyl 5-[(4-fluorophenyl)carbamoylamino]-1-(2-oxidanylpropyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-fluorophenyl)carbamoylamino]-1-(2-oxidanylpropyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[(4-fluorophenyl)carbamoylamino]-1-(2-hydroxypropyl)pyrazole-4-carboxylate CAS Name: 5-[[(4-fluoroanilino)-oxomethyl]amino]-1-(2-hydroxypropyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-fluorophenyl)carbamoylamino]-1-(2-hydroxypropyl)pyrazole-4-carboxylate Traditional Name: 5-[(4-fluorophenyl)carbamoylamino]-1-(2-hydroxypropyl)pyrazole-4-carboxylic acid ethyl ester Formula: C16H19FN4O4 MolecularWeight: 350.344863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CC(C)O)NC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CC(C)O)NC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FN4O4/c1-3-25-15(23)13-8-18-21(9-10(2)22)14(13)20-16(24)19-12-6-4-11(17)5-7-12/h4-8,10,22H,3,9H2,1-2H3,(H2,19,20,24)