N-[5-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide

Systemtic Name: N-[5-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide Openeye Name: N-[5-[(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzamide CAS Name: N-[5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzamide IUPAC Name: N-[5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide Traditional Name: N-[5-(3-bromo-5-methoxy-4-propargyloxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]benzamide Formula: C21H15BrN2O4S2 MolecularWeight: 503.3888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)NC(=O)C3=CC=CC=C3)Br)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)NC(=O)C3=CC=CC=C3)Br)OCC#C

InChI

InChI=1S/C21H15BrN2O4S2/c1-3-9-28-18-15(22)10-13(11-16(18)27-2)12-17-20(26)24(21(29)30-17)23-19(25)14-7-5-4-6-8-14/h1,4-8,10-12H,9H2,2H3,(H,23,25)