2-[(5E)-4-oxidanylidene-5-(phenylazanylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid

Systemtic Name: 2-[(5E)-4-oxidanylidene-5-(phenylazanylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Openeye Name: 2-[(5E)-5-(anilinomethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid CAS Name: 2-[(5E)-5-(anilinomethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethanesulfonic acid IUPAC Name: 2-[(5E)-5-(anilinomethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Traditional Name: 2-[(5E)-5-(anilinomethylene)-4-keto-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid Formula: C12H12N2O4S3 MolecularWeight: 344.42968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC=C2C(=O)N(C(=S)S2)CCS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N/C=C/2\C(=O)N(C(=S)S2)CCS(=O)(=O)O

InChI

InChI=1S/C12H12N2O4S3/c15-11-10(8-13-9-4-2-1-3-5-9)20-12(19)14(11)6-7-21(16,17)18/h1-5,8,13H,6-7H2,(H,16,17,18)/b10-8+