2-[(5Z)-4-oxidanylidene-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate

Systemtic Name: 2-[(5Z)-4-oxidanylidene-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate Openeye Name: 2-[(5Z)-4-oxo-5-(4-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]ethanesulfonate CAS Name: 2-[(5Z)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-3-thiazolidinyl]ethanesulfonate IUPAC Name: 2-[(5Z)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonate Traditional Name: 2-[(5Z)-4-keto-5-(4-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]ethanesulfonate Formula: C11H9N2O4S3- MolecularWeight: 329.39516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C=C2C(=O)N(C(=S)S2)CCS(=O)(=O)[O-]

Isomeric SMILES

C1=CN=CC=C1/C=C\2/C(=O)N(C(=S)S2)CCS(=O)(=O)[O-]

InChI

InChI=1S/C11H10N2O4S3/c14-10-9(7-8-1-3-12-4-2-8)19-11(18)13(10)5-6-20(15,16)17/h1-4,7H,5-6H2,(H,15,16,17)/p-1/b9-7-