2-butylsulfanyl-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-butylsulfanyl-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one Openeye Name: 2-butylsulfanyl-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one CAS Name: 2-(butylthio)-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one IUPAC Name: 2-butylsulfanyl-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one Traditional Name: 2-(butylthio)-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C(=C(N1)C)COC2=CC=CC=C2

Isomeric SMILES

CCCCSC1=NC(=O)C(=C(N1)C)COC2=CC=CC=C2

InChI

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