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

Systemtic Name: 5-[(4-chlorophenyl)methyl]-6-methyl-2-prop-2-enylsulfanyl-1H-pyrimidin-4-one Openeye Name: 2-allylsulfanyl-5-[(4-chlorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 5-[(4-chlorophenyl)methyl]-6-methyl-2-(prop-2-enylthio)-1H-pyrimidin-4-one IUPAC Name: 5-[(4-chlorophenyl)methyl]-6-methyl-2-prop-2-enylsulfanyl-1H-pyrimidin-4-one Traditional Name: 2-(allylthio)-5-(4-chlorobenzyl)-6-methyl-1H-pyrimidin-4-one Formula: C15H15ClN2OS MolecularWeight: 306.8104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15ClN2OS/c1-3-8-20-15-17-10(2)13(14(19)18-15)9-11-4-6-12(16)7-5-11/h3-7H,1,8-9H2,2H3,(H,17,18,19)