1-[1-(3-methoxyphenyl)-6-methyl-4-(phenylmethylsulfanyl)-2-sulfanylidene-pyridin-3-yl]ethanone

Systemtic Name: 1-[1-(3-methoxyphenyl)-6-methyl-4-(phenylmethylsulfanyl)-2-sulfanylidene-pyridin-3-yl]ethanone Openeye Name: 1-[4-benzylsulfanyl-1-(3-methoxyphenyl)-6-methyl-2-thioxo-3-pyridyl]ethanone CAS Name: 1-[1-(3-methoxyphenyl)-6-methyl-4-(phenylmethylthio)-2-sulfanylidene-3-pyridinyl]ethanone IUPAC Name: 1-[4-benzylsulfanyl-1-(3-methoxyphenyl)-6-methyl-2-sulfanylidenepyridin-3-yl]ethanone Traditional Name: 1-[4-(benzylthio)-1-(3-methoxyphenyl)-6-methyl-2-thioxo-3-pyridyl]ethanone Formula: C22H21NO2S2 MolecularWeight: 395.53764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=S)N1C2=CC(=CC=C2)OC)C(=O)C)SCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C(=S)N1C2=CC(=CC=C2)OC)C(=O)C)SCC3=CC=CC=C3

InChI

InChI=1S/C22H21NO2S2/c1-15-12-20(27-14-17-8-5-4-6-9-17)21(16(2)24)22(26)23(15)18-10-7-11-19(13-18)25-3/h4-13H,14H2,1-3H3