(2R)-2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoate

Systemtic Name: (2R)-2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoate Openeye Name: (2R)-2-[(5E)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]pentanoate CAS Name: (2R)-2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]pentanoate IUPAC Name: (2R)-2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoate Traditional Name: (2R)-2-[(5E)-4-keto-5-piperonylidene-2-thioxo-thiazolidin-3-yl]valerate Formula: C16H14NO5S2- MolecularWeight: 364.41606

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])N1C(=O)C(=CC2=CC3=C(C=C2)OCO3)SC1=S

Isomeric SMILES

CCC[C@H](C(=O)[O-])N1C(=O)/C(=C\C2=CC3=C(C=C2)OCO3)/SC1=S

InChI

InChI=1S/C16H15NO5S2/c1-2-3-10(15(19)20)17-14(18)13(24-16(17)23)7-9-4-5-11-12(6-9)22-8-21-11/h4-7,10H,2-3,8H2,1H3,(H,19,20)/p-1/b13-7+/t10-/m1/s1