(5Z)-5-[[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazol-4-olate

Systemtic Name: (5Z)-5-[[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazol-4-olate Openeye Name: (5Z)-5-[[3-bromo-5-methoxy-4-(2-pyridylmethoxy)phenyl]methylene]-2-thioxo-thiazol-4-olate CAS Name: (5Z)-5-[[3-bromo-5-methoxy-4-(2-pyridinylmethoxy)phenyl]methylidene]-2-sulfanylidene-4-thiazololate IUPAC Name: (5Z)-5-[[3-bromo-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazol-4-olate Traditional Name: (5Z)-5-[3-bromo-5-methoxy-4-(2-pyridylmethoxy)benzylidene]-2-thioxo-3-thiazolin-4-olate Formula: C17H12BrN2O3S2- MolecularWeight: 436.32278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=NC(=S)S2)[O-])Br)OCC3=CC=CC=N3

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C\2/C(=NC(=S)S2)[O-])Br)OCC3=CC=CC=N3

InChI

InChI=1S/C17H13BrN2O3S2/c1-22-13-7-10(8-14-16(21)20-17(24)25-14)6-12(18)15(13)23-9-11-4-2-3-5-19-11/h2-8H,9H2,1H3,(H,20,21,24)/p-1/b14-8-