2-[(2,4-dimethylphenyl)methyl]-4-oxidanyl-5-(2-prop-2-enylsulfanylethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[(2,4-dimethylphenyl)methyl]-4-oxidanyl-5-(2-prop-2-enylsulfanylethyl)-1H-pyrimidin-6-one Openeye Name: 5-(2-allylsulfanylethyl)-2-[(2,4-dimethylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-[(2,4-dimethylphenyl)methyl]-4-hydroxy-5-[2-(prop-2-enylthio)ethyl]-1H-pyrimidin-6-one IUPAC Name: 2-[(2,4-dimethylphenyl)methyl]-4-hydroxy-5-(2-prop-2-enylsulfanylethyl)-1H-pyrimidin-6-one Traditional Name: 5-[2-(allylthio)ethyl]-2-(2,4-dimethylbenzyl)-4-hydroxy-1H-pyrimidin-6-one Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC2=NC(=C(C(=O)N2)CCSCC=C)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)CC2=NC(=C(C(=O)N2)CCSCC=C)O)C

InChI

InChI=1S/C18H22N2O2S/c1-4-8-23-9-7-15-17(21)19-16(20-18(15)22)11-14-6-5-12(2)10-13(14)3/h4-6,10H,1,7-9,11H2,2-3H3,(H2,19,20,21,22)