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2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-6-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one

2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-6-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name:2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-6-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one
Openeye Name:5-benzyl-2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one
CAS Name:2-[2-(3,5-dimethylphenoxy)ethylthio]-6-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one
IUPAC Name:5-benzyl-2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-6-methyl-1H-pyrimidin-4-one
Traditional Name:5-benzyl-2-[2-(3,5-dimethylphenoxy)ethylthio]-6-methyl-1H-pyrimidin-4-one
Formula: C22H24N2O2S
MolecularWeight: 380.50316
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCSC2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)C


Isomeric SMILES

CC1=CC(=CC(=C1)OCCSC2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)C


InChI

InChI=1S/C22H24N2O2S/c1-15-11-16(2)13-19(12-15)26-9-10-27-22-23-17(3)20(21(25)24-22)14-18-7-5-4-6-8-18/h4-8,11-13H,9-10,14H2,1-3H3,(H,23,24,25)


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