5-[(3-methoxyphenyl)methyl]-3,6-dimethyl-2-prop-2-enylsulfanyl-pyrimidin-4-one

Systemtic Name: 5-[(3-methoxyphenyl)methyl]-3,6-dimethyl-2-prop-2-enylsulfanyl-pyrimidin-4-one Openeye Name: 2-allylsulfanyl-5-[(3-methoxyphenyl)methyl]-3,6-dimethyl-pyrimidin-4-one CAS Name: 5-[(3-methoxyphenyl)methyl]-3,6-dimethyl-2-(prop-2-enylthio)-4-pyrimidinone IUPAC Name: 5-[(3-methoxyphenyl)methyl]-3,6-dimethyl-2-prop-2-enylsulfanylpyrimidin-4-one Traditional Name: 2-(allylthio)-5-m-anisyl-3,6-dimethyl-pyrimidin-4-one Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCC=C)C)CC2=CC(=CC=C2)OC

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCC=C)C)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C17H20N2O2S/c1-5-9-22-17-18-12(2)15(16(20)19(17)3)11-13-7-6-8-14(10-13)21-4/h5-8,10H,1,9,11H2,2-4H3