5-[(4-methoxyphenyl)methyl]-6-methyl-2-(2-methylpropylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-6-methyl-2-(2-methylpropylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 2-isobutylsulfanyl-5-[(4-methoxyphenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 5-[(4-methoxyphenyl)methyl]-6-methyl-2-(2-methylpropylthio)-1H-pyrimidin-4-one IUPAC Name: 5-[(4-methoxyphenyl)methyl]-6-methyl-2-(2-methylpropylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 2-(isobutylthio)-6-methyl-5-p-anisyl-1H-pyrimidin-4-one Formula: C17H22N2O2S MolecularWeight: 318.43378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(C)C)CC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(C)C)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H22N2O2S/c1-11(2)10-22-17-18-12(3)15(16(20)19-17)9-13-5-7-14(21-4)8-6-13/h5-8,11H,9-10H2,1-4H3,(H,18,19,20)