2-butan-2-ylsulfanyl-6-[(3-methoxyphenyl)methyl]-1H-pyrimidin-4-one

Systemtic Name: 2-butan-2-ylsulfanyl-6-[(3-methoxyphenyl)methyl]-1H-pyrimidin-4-one Openeye Name: 6-[(3-methoxyphenyl)methyl]-2-sec-butylsulfanyl-1H-pyrimidin-4-one CAS Name: 2-(butan-2-ylthio)-6-[(3-methoxyphenyl)methyl]-1H-pyrimidin-4-one IUPAC Name: 2-butan-2-ylsulfanyl-6-[(3-methoxyphenyl)methyl]-1H-pyrimidin-4-one Traditional Name: 6-m-anisyl-2-(sec-butylthio)-1H-pyrimidin-4-one Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NC(=O)C=C(N1)CC2=CC(=CC=C2)OC

Isomeric SMILES

CCC(C)SC1=NC(=O)C=C(N1)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C16H20N2O2S/c1-4-11(2)21-16-17-13(10-15(19)18-16)8-12-6-5-7-14(9-12)20-3/h5-7,9-11H,4,8H2,1-3H3,(H,17,18,19)