methyl 6-[4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: methyl 6-[4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: methyl 6-(5-benzylidene-4-oxo-2-thioxo-thiazolidin-3-yl)hexanoate CAS Name: 6-[4-oxo-5-(phenylmethylene)-2-sulfanylidene-3-thiazolidinyl]hexanoic acid methyl ester IUPAC Name: methyl 6-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)hexanoate Traditional Name: 6-(5-benzal-4-keto-2-thioxo-thiazolidin-3-yl)hexanoic acid methyl ester Formula: C17H19NO3S2 MolecularWeight: 349.46766

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCN1C(=O)C(=CC2=CC=CC=C2)SC1=S

Isomeric SMILES

COC(=O)CCCCCN1C(=O)C(=CC2=CC=CC=C2)SC1=S

InChI

InChI=1S/C17H19NO3S2/c1-21-15(19)10-6-3-7-11-18-16(20)14(23-17(18)22)12-13-8-4-2-5-9-13/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3