pentyl 3-[(5E)-2-oxidanylidene-5-(phenylmethylidene)-4-sulfanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: pentyl 3-[(5E)-2-oxidanylidene-5-(phenylmethylidene)-4-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: pentyl 3-[(5E)-5-benzylidene-2-oxo-4-thioxo-thiazolidin-3-yl]propanoate CAS Name: 3-[(5E)-2-oxo-5-(phenylmethylene)-4-sulfanylidene-3-thiazolidinyl]propanoic acid pentyl ester IUPAC Name: pentyl 3-[(5E)-5-benzylidene-2-oxo-4-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[(5E)-5-benzal-2-keto-4-thioxo-thiazolidin-3-yl]propionic acid amyl ester Formula: C18H21NO3S2 MolecularWeight: 363.49424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CCN1C(=S)C(=CC2=CC=CC=C2)SC1=O

Isomeric SMILES

CCCCCOC(=O)CCN1C(=S)/C(=C\C2=CC=CC=C2)/SC1=O

InChI

InChI=1S/C18H21NO3S2/c1-2-3-7-12-22-16(20)10-11-19-17(23)15(24-18(19)21)13-14-8-5-4-6-9-14/h4-6,8-9,13H,2-3,7,10-12H2,1H3/b15-13+