N-[(1S)-2-(tert-butylamino)-1-(4-fluorophenyl)-2-oxidanylidene-ethyl]-N-phenethyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(1S)-2-(tert-butylamino)-1-(4-fluorophenyl)-2-oxidanylidene-ethyl]-N-phenethyl-1H-pyrazole-5-carboxamide Openeye Name: N-[(1S)-2-(tert-butylamino)-1-(4-fluorophenyl)-2-oxo-ethyl]-N-phenethyl-1H-pyrazole-5-carboxamide CAS Name: N-[(1S)-2-(tert-butylamino)-1-(4-fluorophenyl)-2-oxoethyl]-N-phenethyl-1H-pyrazole-5-carboxamide IUPAC Name: N-[(1S)-2-(tert-butylamino)-1-(4-fluorophenyl)-2-oxoethyl]-N-phenethyl-1H-pyrazole-5-carboxamide Traditional Name: N-[(1S)-2-(tert-butylamino)-1-(4-fluorophenyl)-2-keto-ethyl]-N-phenethyl-1H-pyrazole-5-carboxamide Formula: C24H27FN4O2 MolecularWeight: 422.495183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=C(C=C1)F)N(CCC2=CC=CC=C2)C(=O)C3=CC=NN3

Isomeric SMILES

CC(C)(C)NC(=O)[C@H](C1=CC=C(C=C1)F)N(CCC2=CC=CC=C2)C(=O)C3=CC=NN3

InChI

InChI=1S/C24H27FN4O2/c1-24(2,3)27-22(30)21(18-9-11-19(25)12-10-18)29(23(31)20-13-15-26-28-20)16-14-17-7-5-4-6-8-17/h4-13,15,21H,14,16H2,1-3H3,(H,26,28)(H,27,30)/t21-/m0/s1