(4S)-7-fluoranyl-2-oxidanylidene-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-3,4-dihydro-1H-quinoline-4-carboxamide

Systemtic Name: (4S)-7-fluoranyl-2-oxidanylidene-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-3,4-dihydro-1H-quinoline-4-carboxamide Openeye Name: (4S)-7-fluoro-2-oxo-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-3,4-dihydro-1H-quinoline-4-carboxamide CAS Name: (4S)-7-fluoro-2-oxo-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]-3,4-dihydro-1H-quinoline-4-carboxamide IUPAC Name: (4S)-7-fluoro-2-oxo-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-3,4-dihydro-1H-quinoline-4-carboxamide Traditional Name: (4S)-7-fluoro-2-keto-N-[2-(pyrazol-1-ylmethyl)benzyl]-3,4-dihydro-1H-quinoline-4-carboxamide Formula: C21H19FN4O2 MolecularWeight: 378.399563

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=C(C=C2)F)NC1=O)C(=O)NCC3=CC=CC=C3CN4C=CC=N4

Isomeric SMILES

C1[C@@H](C2=C(C=C(C=C2)F)NC1=O)C(=O)NCC3=CC=CC=C3CN4C=CC=N4

InChI

InChI=1S/C21H19FN4O2/c22-16-6-7-17-18(11-20(27)25-19(17)10-16)21(28)23-12-14-4-1-2-5-15(14)13-26-9-3-8-24-26/h1-10,18H,11-13H2,(H,23,28)(H,25,27)/t18-/m0/s1