3-cyano-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(2-methylpropyl)benzamide

Systemtic Name: 3-cyano-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(2-methylpropyl)benzamide Openeye Name: 3-cyano-4-isobutyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide CAS Name: 3-cyano-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(2-methylpropyl)benzamide IUPAC Name: 3-cyano-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(2-methylpropyl)benzamide Traditional Name: 3-cyano-4-isobutyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C)C=C2)C#N

Isomeric SMILES

CC(C)CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C)C=C2)C#N

InChI

InChI=1S/C22H25N3O/c1-15(2)10-17-4-5-18(11-19(17)13-23)22(26)24-21-7-6-16-8-9-25(3)14-20(16)12-21/h4-7,11-12,15H,8-10,14H2,1-3H3,(H,24,26)