8-chloranyl-N-[(S)-(3-fluorophenyl)-(2-oxidanylidenecyclopropyl)methyl]-3-methyl-2-phenyl-1H-isoquinoline-4-carboxamide

Systemtic Name: 8-chloranyl-N-[(S)-(3-fluorophenyl)-(2-oxidanylidenecyclopropyl)methyl]-3-methyl-2-phenyl-1H-isoquinoline-4-carboxamide Openeye Name: 8-chloro-N-[(S)-(3-fluorophenyl)-(2-oxocyclopropyl)methyl]-3-methyl-2-phenyl-1H-isoquinoline-4-carboxamide CAS Name: 8-chloro-N-[(S)-(3-fluorophenyl)-(2-oxocyclopropyl)methyl]-3-methyl-2-phenyl-1H-isoquinoline-4-carboxamide IUPAC Name: 8-chloro-N-[(S)-(3-fluorophenyl)-(2-oxocyclopropyl)methyl]-3-methyl-2-phenyl-1H-isoquinoline-4-carboxamide Traditional Name: 8-chloro-N-[(S)-(3-fluorophenyl)-(2-ketocyclopropyl)methyl]-3-methyl-2-phenyl-1H-isoquinoline-4-carboxamide Formula: C27H22ClFN2O2 MolecularWeight: 460.927183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(CN1C3=CC=CC=C3)C(=CC=C2)Cl)C(=O)NC(C4CC4=O)C5=CC(=CC=C5)F

Isomeric SMILES

CC1=C(C2=C(CN1C3=CC=CC=C3)C(=CC=C2)Cl)C(=O)N[C@@H](C4CC4=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C27H22ClFN2O2/c1-16-25(27(33)30-26(21-14-24(21)32)17-7-5-8-18(29)13-17)20-11-6-12-23(28)22(20)15-31(16)19-9-3-2-4-10-19/h2-13,21,26H,14-15H2,1H3,(H,30,33)/t21?,26-/m1/s1