5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-6-methyl-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-6-methyl-2-(methylthio)-1H-pyrimidin-4-one Formula: C21H24N4OS MolecularWeight: 380.50646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCN2CCC(=CC2)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCN2CCC(=CC2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H24N4OS/c1-14-16(20(26)24-21(23-14)27-2)9-12-25-10-7-15(8-11-25)18-13-22-19-6-4-3-5-17(18)19/h3-7,13,22H,8-12H2,1-2H3,(H,23,24,26)