methyl 1-[C-(4-fluorophenyl)-N-(2-methylpropyl)carbonimidoyl]-5-methyl-pyrazole-3-carboxylate

Systemtic Name: methyl 1-[C-(4-fluorophenyl)-N-(2-methylpropyl)carbonimidoyl]-5-methyl-pyrazole-3-carboxylate Openeye Name: methyl 1-[C-(4-fluorophenyl)-N-isobutyl-carbonimidoyl]-5-methyl-pyrazole-3-carboxylate CAS Name: 1-[(4-fluorophenyl)-(2-methylpropylimino)methyl]-5-methyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[C-(4-fluorophenyl)-N-(2-methylpropyl)carbonimidoyl]-5-methylpyrazole-3-carboxylate Traditional Name: 1-[C-(4-fluorophenyl)-N-isobutyl-carbonimidoyl]-5-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C17H20FN3O2 MolecularWeight: 317.358003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=NCC(C)C)C2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

CC1=CC(=NN1C(=NCC(C)C)C2=CC=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C17H20FN3O2/c1-11(2)10-19-16(13-5-7-14(18)8-6-13)21-12(3)9-15(20-21)17(22)23-4/h5-9,11H,10H2,1-4H3