(2-sulfanylidenepyridin-1-yl) 5-(phenyldisulfanyl)pentanoate

Systemtic Name: (2-sulfanylidenepyridin-1-yl) 5-(phenyldisulfanyl)pentanoate Openeye Name: (2-thioxo-1-pyridyl) 5-(phenyldisulfanyl)pentanoate CAS Name: 5-(phenyldisulfanyl)pentanoic acid (2-sulfanylidene-1-pyridinyl) ester IUPAC Name: (2-sulfanylidenepyridin-1-yl) 5-(phenyldisulfanyl)pentanoate Traditional Name: 5-(phenyldisulfanyl)valeric acid (2-thioxo-1-pyridyl) ester Formula: C16H17NO2S3 MolecularWeight: 351.50668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SSCCCCC(=O)ON2C=CC=CC2=S

Isomeric SMILES

C1=CC=C(C=C1)SSCCCCC(=O)ON2C=CC=CC2=S

InChI

InChI=1S/C16H17NO2S3/c18-16(19-17-12-6-4-10-15(17)20)11-5-7-13-21-22-14-8-2-1-3-9-14/h1-4,6,8-10,12H,5,7,11,13H2