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

Systemtic Name: 5-[(2-methoxy-5-methyl-phenyl)methyl]-6-methyl-2-pentylsulfanyl-1H-pyrimidin-4-one Openeye Name: 5-[(2-methoxy-5-methyl-phenyl)methyl]-6-methyl-2-pentylsulfanyl-1H-pyrimidin-4-one CAS Name: 5-[(2-methoxy-5-methylphenyl)methyl]-6-methyl-2-(pentylthio)-1H-pyrimidin-4-one IUPAC Name: 5-[(2-methoxy-5-methylphenyl)methyl]-6-methyl-2-pentylsulfanyl-1H-pyrimidin-4-one Traditional Name: 2-(amylthio)-5-(2-methoxy-5-methyl-benzyl)-6-methyl-1H-pyrimidin-4-one Formula: C19H26N2O2S MolecularWeight: 346.48694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC(=O)C(=C(N1)C)CC2=C(C=CC(=C2)C)OC

Isomeric SMILES

CCCCCSC1=NC(=O)C(=C(N1)C)CC2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C19H26N2O2S/c1-5-6-7-10-24-19-20-14(3)16(18(22)21-19)12-15-11-13(2)8-9-17(15)23-4/h8-9,11H,5-7,10,12H2,1-4H3,(H,20,21,22)