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

Systemtic Name: 2-(4-methylpyridin-1-ium-1-yl)-3-(naphthalen-1-ylmethylsulfanyl)-1-phenyl-3-sulfanyl-prop-2-en-1-one Openeye Name: 2-(4-methylpyridin-1-ium-1-yl)-3-(1-naphthylmethylsulfanyl)-1-phenyl-3-sulfanyl-prop-2-en-1-one CAS Name: 3-mercapto-2-(4-methyl-1-pyridin-1-iumyl)-3-(1-naphthalenylmethylthio)-1-phenyl-2-propen-1-one IUPAC Name: 2-(4-methylpyridin-1-ium-1-yl)-3-(naphthalen-1-ylmethylsulfanyl)-1-phenyl-3-sulfanylprop-2-en-1-one Traditional Name: 3-mercapto-2-(4-methylpyridin-1-ium-1-yl)-3-(1-naphthylmethylthio)-1-phenyl-prop-2-en-1-one Formula: C26H22NOS2+ MolecularWeight: 428.58898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)C(=C(S)SCC2=CC=CC3=CC=CC=C32)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=[N+](C=C1)C(=C(S)SCC2=CC=CC3=CC=CC=C32)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H21NOS2/c1-19-14-16-27(17-15-19)24(25(28)21-9-3-2-4-10-21)26(29)30-18-22-12-7-11-20-8-5-6-13-23(20)22/h2-17H,18H2,1H3/p+1