2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-isopentyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-isoamyl-6-methyl-1H-pyrimidin-4-one Formula: C19H25N3O MolecularWeight: 311.4213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CCC3=CC=CC=C3C2)CCC(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCC3=CC=CC=C3C2)CCC(C)C

InChI

InChI=1S/C19H25N3O/c1-13(2)8-9-17-14(3)20-19(21-18(17)23)22-11-10-15-6-4-5-7-16(15)12-22/h4-7,13H,8-12H2,1-3H3,(H,20,21,23)