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

Systemtic Name: 5-[(4-chlorophenyl)methyl]-6-methyl-2-(2-methylprop-2-enylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 5-[(4-chlorophenyl)methyl]-6-methyl-2-(2-methylallylsulfanyl)-1H-pyrimidin-4-one CAS Name: 5-[(4-chlorophenyl)methyl]-6-methyl-2-(2-methylprop-2-enylthio)-1H-pyrimidin-4-one IUPAC Name: 5-[(4-chlorophenyl)methyl]-6-methyl-2-(2-methylprop-2-enylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 5-(4-chlorobenzyl)-6-methyl-2-(2-methylallylthio)-1H-pyrimidin-4-one Formula: C16H17ClN2OS MolecularWeight: 320.83698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClN2OS/c1-10(2)9-21-16-18-11(3)14(15(20)19-16)8-12-4-6-13(17)7-5-12/h4-7H,1,8-9H2,2-3H3,(H,18,19,20)