5-[(5-bromanyl-3-methoxy-2-prop-2-ynoxy-phenyl)methylidene]-3-(2-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[(5-bromanyl-3-methoxy-2-prop-2-ynoxy-phenyl)methylidene]-3-(2-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[(5-bromo-3-methoxy-2-prop-2-ynoxy-phenyl)methylene]-3-(o-tolyl)-2-thioxo-thiazolidin-4-one CAS Name: 5-[(5-bromo-3-methoxy-2-prop-2-ynoxyphenyl)methylidene]-3-(2-methylphenyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[(5-bromo-3-methoxy-2-prop-2-ynoxyphenyl)methylidene]-3-(2-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-(5-bromo-3-methoxy-2-propargyloxy-benzylidene)-3-(o-tolyl)-2-thioxo-thiazolidin-4-one Formula: C21H16BrNO3S2 MolecularWeight: 474.39064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CC3=CC(=CC(=C3OCC#C)OC)Br)SC2=S

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(=CC3=CC(=CC(=C3OCC#C)OC)Br)SC2=S

InChI

InChI=1S/C21H16BrNO3S2/c1-4-9-26-19-14(10-15(22)12-17(19)25-3)11-18-20(24)23(21(27)28-18)16-8-6-5-7-13(16)2/h1,5-8,10-12H,9H2,2-3H3