N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanamide

Systemtic Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanamide Openeye Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide CAS Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-2-pyrrolyl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide IUPAC Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethylpyrrol-2-yl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Traditional Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Formula: C24H23FN4O MolecularWeight: 402.464023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCC3=CC=CC=C3C2)C4=CC(=CC=C4)F)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCC3=CC=CC=C3C2)C4=CC(=CC=C4)F)C

InChI

InChI=1S/C24H23FN4O/c1-16-17(2)29(21-9-5-8-20(25)12-21)24(22(16)13-26)27-23(30)15-28-11-10-18-6-3-4-7-19(18)14-28/h3-9,12H,10-11,14-15H2,1-2H3,(H,27,30)