N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-2-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-methyl-2-(methylthio)pyrimidine-5-carboxamide Formula: C19H24N4OS MolecularWeight: 356.48506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCCCN2CCC3=CC=CC=C3C2)SC

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCCCN2CCC3=CC=CC=C3C2)SC

InChI

InChI=1S/C19H24N4OS/c1-14-17(12-21-19(22-14)25-2)18(24)20-9-5-10-23-11-8-15-6-3-4-7-16(15)13-23/h3-4,6-7,12H,5,8-11,13H2,1-2H3,(H,20,24)