2-[4-(2,4-dimethylphenoxy)butylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(2,4-dimethylphenoxy)butylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[4-(2,4-dimethylphenoxy)butylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[4-(2,4-dimethylphenoxy)butylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[4-(2,4-dimethylphenoxy)butylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[4-(2,4-dimethylphenoxy)butylthio]-6-methyl-1H-pyrimidin-4-one Formula: C17H22N2O2S MolecularWeight: 318.43378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCCSC2=NC(=O)C=C(N2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCCSC2=NC(=O)C=C(N2)C)C

InChI

InChI=1S/C17H22N2O2S/c1-12-6-7-15(13(2)10-12)21-8-4-5-9-22-17-18-14(3)11-16(20)19-17/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,18,19,20)