2-methoxy-6-nitro-4-[(Z)-(4-oxidanylidene-3-pyridin-3-yl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate

Systemtic Name: 2-methoxy-6-nitro-4-[(Z)-(4-oxidanylidene-3-pyridin-3-yl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate Openeye Name: 2-methoxy-6-nitro-4-[(Z)-[4-oxo-3-(3-pyridyl)-2-thioxo-thiazolidin-5-ylidene]methyl]phenolate CAS Name: 2-methoxy-6-nitro-4-[(Z)-[4-oxo-3-(3-pyridinyl)-2-sulfanylidene-5-thiazolidinylidene]methyl]phenolate IUPAC Name: 2-methoxy-6-nitro-4-[(Z)-(4-oxo-3-pyridin-3-yl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate Traditional Name: 4-[(Z)-[4-keto-3-(3-pyridyl)-2-thioxo-thiazolidin-5-ylidene]methyl]-2-methoxy-6-nitro-phenolate Formula: C16H10N3O5S2- MolecularWeight: 388.3977

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=O)N(C(=S)S2)C3=CN=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C\2/C(=O)N(C(=S)S2)C3=CN=CC=C3

InChI

InChI=1S/C16H11N3O5S2/c1-24-12-6-9(5-11(14(12)20)19(22)23)7-13-15(21)18(16(25)26-13)10-3-2-4-17-8-10/h2-8,20H,1H3/p-1/b13-7-