2-butylsulfanyl-6-methyl-5-[2-(2-methylphenoxy)ethyl]-1H-pyrimidin-4-one

Systemtic Name: 2-butylsulfanyl-6-methyl-5-[2-(2-methylphenoxy)ethyl]-1H-pyrimidin-4-one Openeye Name: 2-butylsulfanyl-6-methyl-5-[2-(2-methylphenoxy)ethyl]-1H-pyrimidin-4-one CAS Name: 2-(butylthio)-6-methyl-5-[2-(2-methylphenoxy)ethyl]-1H-pyrimidin-4-one IUPAC Name: 2-butylsulfanyl-6-methyl-5-[2-(2-methylphenoxy)ethyl]-1H-pyrimidin-4-one Traditional Name: 2-(butylthio)-6-methyl-5-[2-(2-methylphenoxy)ethyl]-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)CCOC2=CC=CC=C2C

Isomeric SMILES

CCCCSC1=NC(=O)C(=C(N1)C)CCOC2=CC=CC=C2C

InChI

InChI=1S/C18H24N2O2S/c1-4-5-12-23-18-19-14(3)15(17(21)20-18)10-11-22-16-9-7-6-8-13(16)2/h6-9H,4-5,10-12H2,1-3H3,(H,19,20,21)