N-cyclobutyl-4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-oxidanylidene-3,4-dihydroisoquinolin-6-yl]-3-fluoranyl-benzamide

Systemtic Name: N-cyclobutyl-4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-oxidanylidene-3,4-dihydroisoquinolin-6-yl]-3-fluoranyl-benzamide Openeye Name: N-cyclobutyl-4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-oxo-3,4-dihydroisoquinolin-6-yl]-3-fluoro-benzamide CAS Name: N-cyclobutyl-4-[2-[(3S)-1-cyclobutyl-3-pyrrolidinyl]-1-oxo-3,4-dihydroisoquinolin-6-yl]-3-fluorobenzamide IUPAC Name: N-cyclobutyl-4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-oxo-3,4-dihydroisoquinolin-6-yl]-3-fluorobenzamide Traditional Name: N-cyclobutyl-4-[2-[(3S)-1-cyclobutylpyrrolidin-3-yl]-1-keto-3,4-dihydroisoquinolin-6-yl]-3-fluoro-benzamide Formula: C28H32FN3O2 MolecularWeight: 461.570983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)NC(=O)C2=CC(=C(C=C2)C3=CC4=C(C=C3)C(=O)N(CC4)C5CCN(C5)C6CCC6)F

Isomeric SMILES

C1CC(C1)NC(=O)C2=CC(=C(C=C2)C3=CC4=C(C=C3)C(=O)N(CC4)[C@H]5CCN(C5)C6CCC6)F

InChI

InChI=1S/C28H32FN3O2/c29-26-16-20(27(33)30-21-3-1-4-21)8-9-24(26)18-7-10-25-19(15-18)11-14-32(28(25)34)23-12-13-31(17-23)22-5-2-6-22/h7-10,15-16,21-23H,1-6,11-14,17H2,(H,30,33)/t23-/m0/s1