2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[(4,5-dimethoxy-2-methylphenyl)methylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[(4,5-dimethoxy-2-methyl-benzyl)thio]-6-propyl-1H-pyrimidin-4-one Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=CC(=C(C=C2C)OC)OC

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=CC(=C(C=C2C)OC)OC

InChI

InChI=1S/C17H22N2O3S/c1-5-6-13-9-16(20)19-17(18-13)23-10-12-8-15(22-4)14(21-3)7-11(12)2/h7-9H,5-6,10H2,1-4H3,(H,18,19,20)