5-[(4-fluorophenyl)methyl]-6-methyl-2-[2-(2-methylprop-2-enylsulfanyl)ethylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-fluorophenyl)methyl]-6-methyl-2-[2-(2-methylprop-2-enylsulfanyl)ethylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 5-[(4-fluorophenyl)methyl]-6-methyl-2-[2-(2-methylallylsulfanyl)ethylsulfanyl]-1H-pyrimidin-4-one CAS Name: 5-[(4-fluorophenyl)methyl]-6-methyl-2-[2-(2-methylprop-2-enylthio)ethylthio]-1H-pyrimidin-4-one IUPAC Name: 5-[(4-fluorophenyl)methyl]-6-methyl-2-[2-(2-methylprop-2-enylsulfanyl)ethylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 5-(4-fluorobenzyl)-6-methyl-2-[2-(2-methylallylthio)ethylthio]-1H-pyrimidin-4-one Formula: C18H21FN2OS2 MolecularWeight: 364.500543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCCSCC(=C)C)CC2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCCSCC(=C)C)CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H21FN2OS2/c1-12(2)11-23-8-9-24-18-20-13(3)16(17(22)21-18)10-14-4-6-15(19)7-5-14/h4-7H,1,8-11H2,2-3H3,(H,20,21,22)