2-butylsulfanyl-5-[(2-methoxy-5-methyl-phenyl)methyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-butylsulfanyl-5-[(2-methoxy-5-methyl-phenyl)methyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-butylsulfanyl-5-[(2-methoxy-5-methyl-phenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(butylthio)-5-[(2-methoxy-5-methylphenyl)methyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-butylsulfanyl-5-[(2-methoxy-5-methylphenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(butylthio)-5-(2-methoxy-5-methyl-benzyl)-6-methyl-1H-pyrimidin-4-one Formula: C18H24N2O2S MolecularWeight: 332.46036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C(=C(N1)C)CC2=C(C=CC(=C2)C)OC

Isomeric SMILES

CCCCSC1=NC(=O)C(=C(N1)C)CC2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C18H24N2O2S/c1-5-6-9-23-18-19-13(3)15(17(21)20-18)11-14-10-12(2)7-8-16(14)22-4/h7-8,10H,5-6,9,11H2,1-4H3,(H,19,20,21)