(Z)-2-(4-methylpyridin-1-ium-1-yl)-3-(naphthalen-1-ylmethylsulfanyl)-3-phenacylsulfanyl-1-phenyl-prop-2-en-1-one bromide

Systemtic Name: (Z)-2-(4-methylpyridin-1-ium-1-yl)-3-(naphthalen-1-ylmethylsulfanyl)-3-phenacylsulfanyl-1-phenyl-prop-2-en-1-one bromide Openeye Name: (Z)-2-(4-methylpyridin-1-ium-1-yl)-3-(1-naphthylmethylsulfanyl)-3-phenacylsulfanyl-1-phenyl-prop-2-en-1-one bromide CAS Name: (Z)-2-(4-methyl-1-pyridin-1-iumyl)-3-(1-naphthalenylmethylthio)-3-(phenacylthio)-1-phenyl-2-propen-1-one bromide IUPAC Name: (Z)-2-(4-methylpyridin-1-ium-1-yl)-3-(naphthalen-1-ylmethylsulfanyl)-3-phenacylsulfanyl-1-phenylprop-2-en-1-one bromide Traditional Name: (Z)-2-(4-methylpyridin-1-ium-1-yl)-3-(1-naphthylmethylthio)-3-(phenacylthio)-1-phenyl-prop-2-en-1-one bromide Formula: C34H28BrNO2S2 MolecularWeight: 626.62562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)C(=C(SCC2=CC=CC3=CC=CC=C32)SCC(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CC1=CC=[N+](C=C1)/C(=C(/SCC2=CC=CC3=CC=CC=C32)\SCC(=O)C4=CC=CC=C4)/C(=O)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C34H28NO2S2.BrH/c1-25-19-21-35(22-20-25)32(33(37)28-14-6-3-7-15-28)34(39-24-31(36)27-12-4-2-5-13-27)38-23-29-17-10-16-26-11-8-9-18-30(26)29;/h2-22H,23-24H2,1H3;1H/q+1;/p-1/b34-32-;