6-methyl-2-(oxolan-2-ylmethylsulfanyl)-3-phenyl-pyrimidin-4-one

Systemtic Name: 6-methyl-2-(oxolan-2-ylmethylsulfanyl)-3-phenyl-pyrimidin-4-one Openeye Name: 6-methyl-3-phenyl-2-(tetrahydrofuran-2-ylmethylsulfanyl)pyrimidin-4-one CAS Name: 6-methyl-2-(2-oxolanylmethylthio)-3-phenyl-4-pyrimidinone IUPAC Name: 6-methyl-2-(oxolan-2-ylmethylsulfanyl)-3-phenylpyrimidin-4-one Traditional Name: 6-methyl-3-phenyl-2-(tetrahydrofurfurylthio)pyrimidin-4-one Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC2CCCO2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC2CCCO2)C3=CC=CC=C3

InChI

InChI=1S/C16H18N2O2S/c1-12-10-15(19)18(13-6-3-2-4-7-13)16(17-12)21-11-14-8-5-9-20-14/h2-4,6-7,10,14H,5,8-9,11H2,1H3