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

Systemtic Name: N-[3-cyano-4,5-dimethyl-1-(phenylmethyl)pyrrol-2-yl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanamide Openeye Name: N-(1-benzyl-3-cyano-4,5-dimethyl-pyrrol-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide CAS Name: N-[3-cyano-4,5-dimethyl-1-(phenylmethyl)-2-pyrrolyl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide IUPAC Name: N-(1-benzyl-3-cyano-4,5-dimethylpyrrol-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Traditional Name: N-(1-benzyl-3-cyano-4,5-dimethyl-pyrrol-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)acetamide Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCC3=CC=CC=C3C2)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCC3=CC=CC=C3C2)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H26N4O/c1-18-19(2)29(15-20-8-4-3-5-9-20)25(23(18)14-26)27-24(30)17-28-13-12-21-10-6-7-11-22(21)16-28/h3-11H,12-13,15-17H2,1-2H3,(H,27,30)