2-[(5E)-5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethylazanium

Systemtic Name: 2-[(5E)-5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethylazanium Openeye Name: 2-[(5E)-5-[(4-hydroxy-3-methoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]ethylammonium CAS Name: 2-[(5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethylammonium IUPAC Name: 2-[(5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethylazanium Traditional Name: 2-[(5E)-4-keto-2-thioxo-5-vanillylidene-thiazolidin-3-yl]ethylammonium Formula: C13H15N2O3S2+ MolecularWeight: 311.3998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC[NH3+])O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)CC[NH3+])O

InChI

InChI=1S/C13H14N2O3S2/c1-18-10-6-8(2-3-9(10)16)7-11-12(17)15(5-4-14)13(19)20-11/h2-3,6-7,16H,4-5,14H2,1H3/p+1/b11-7+