N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1-(4-fluorophenyl)-N-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1-(4-fluorophenyl)-N-methyl-pyrazole-3-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-1-(4-fluorophenyl)-N-methyl-pyrazole-3-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-(4-fluorophenyl)-N-methyl-3-pyrazolecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-(4-fluorophenyl)-N-methylpyrazole-3-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-1-(4-fluorophenyl)-N-methyl-pyrazole-3-carboxamide Formula: C17H21FN4O2 MolecularWeight: 332.372643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C1=NN(C=C1)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C1=NN(C=C1)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H21FN4O2/c1-17(2,3)19-15(23)11-21(4)16(24)14-9-10-22(20-14)13-7-5-12(18)6-8-13/h5-10H,11H2,1-4H3,(H,19,23)