6-[(E)-2-(4-chlorophenyl)ethenyl]-4,4-dimethyl-2-methylsulfanyl-1H-pyrimidin-3-ium

Systemtic Name: 6-[(E)-2-(4-chlorophenyl)ethenyl]-4,4-dimethyl-2-methylsulfanyl-1H-pyrimidin-3-ium Openeye Name: 6-[(E)-2-(4-chlorophenyl)vinyl]-4,4-dimethyl-2-methylsulfanyl-1H-pyrimidin-3-ium CAS Name: 6-[(E)-2-(4-chlorophenyl)ethenyl]-4,4-dimethyl-2-(methylthio)-1H-pyrimidin-3-ium IUPAC Name: 6-[(E)-2-(4-chlorophenyl)ethenyl]-4,4-dimethyl-2-methylsulfanyl-1H-pyrimidin-3-ium Traditional Name: 6-[(E)-2-(4-chlorophenyl)vinyl]-4,4-dimethyl-2-(methylthio)-1H-pyrimidin-3-ium Formula: C15H18ClN2S+ MolecularWeight: 293.83482

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(NC(=[NH+]1)SC)C=CC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1(C=C(NC(=[NH+]1)SC)/C=C/C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C15H17ClN2S/c1-15(2)10-13(17-14(18-15)19-3)9-6-11-4-7-12(16)8-5-11/h4-10H,1-3H3,(H,17,18)/p+1/b9-6+