N-[(S)-cyclobutyl-(3-fluorophenyl)methyl]-8-fluoranyl-3-methyl-1-oxidanylidene-2-phenyl-isoquinoline-4-carboxamide

Systemtic Name: N-[(S)-cyclobutyl-(3-fluorophenyl)methyl]-8-fluoranyl-3-methyl-1-oxidanylidene-2-phenyl-isoquinoline-4-carboxamide Openeye Name: N-[(S)-cyclobutyl-(3-fluorophenyl)methyl]-8-fluoro-3-methyl-1-oxo-2-phenyl-isoquinoline-4-carboxamide CAS Name: N-[(S)-cyclobutyl-(3-fluorophenyl)methyl]-8-fluoro-3-methyl-1-oxo-2-phenyl-4-isoquinolinecarboxamide IUPAC Name: N-[(S)-cyclobutyl-(3-fluorophenyl)methyl]-8-fluoro-3-methyl-1-oxo-2-phenylisoquinoline-4-carboxamide Traditional Name: N-[(S)-cyclobutyl-(3-fluorophenyl)methyl]-8-fluoro-1-keto-3-methyl-2-phenyl-isoquinoline-4-carboxamide Formula: C28H24F2N2O2 MolecularWeight: 458.499166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=CC=C2)F)C(=O)N1C3=CC=CC=C3)C(=O)NC(C4CCC4)C5=CC(=CC=C5)F

Isomeric SMILES

CC1=C(C2=C(C(=CC=C2)F)C(=O)N1C3=CC=CC=C3)C(=O)N[C@@H](C4CCC4)C5=CC(=CC=C5)F

InChI

InChI=1S/C28H24F2N2O2/c1-17-24(27(33)31-26(18-8-5-9-18)19-10-6-11-20(29)16-19)22-14-7-15-23(30)25(22)28(34)32(17)21-12-3-2-4-13-21/h2-4,6-7,10-16,18,26H,5,8-9H2,1H3,(H,31,33)/t26-/m0/s1