[(2R)-1-(cyclopropylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 5-(4-fluorophenyl)-1H-pyrazole-4-carboxylate

Systemtic Name: [(2R)-1-(cyclopropylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 5-(4-fluorophenyl)-1H-pyrazole-4-carboxylate Openeye Name: [(1R)-2-(cyclopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 5-(4-fluorophenyl)-1H-pyrazole-4-carboxylate CAS Name: 5-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid [(2R)-1-[[(cyclopropylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylcarbamoylamino)-1-oxopropan-2-yl] 5-(4-fluorophenyl)-1H-pyrazole-4-carboxylate Traditional Name: 5-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid [(1R)-2-(cyclopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H17FN4O4 MolecularWeight: 360.339683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)OC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC1CC1)OC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H17FN4O4/c1-9(15(23)21-17(25)20-12-6-7-12)26-16(24)13-8-19-22-14(13)10-2-4-11(18)5-3-10/h2-5,8-9,12H,6-7H2,1H3,(H,19,22)(H2,20,21,23,25)/t9-/m1/s1