5-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-3-(2-methoxyphenyl)-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-3-(2-methoxyphenyl)-1,3-thiazolidine-2,4-dione Openeye Name: 5-[(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-3-(2-methoxyphenyl)thiazolidine-2,4-dione CAS Name: 5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-(2-methoxyphenyl)thiazolidine-2,4-dione IUPAC Name: 5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-(2-methoxyphenyl)-1,3-thiazolidine-2,4-dione Traditional Name: 5-(3-bromo-5-methoxy-4-propargyloxy-benzylidene)-3-(2-methoxyphenyl)thiazolidine-2,4-quinone Formula: C21H16BrNO5S MolecularWeight: 474.32444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C(=C3)Br)OCC#C)OC)SC2=O

Isomeric SMILES

COC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C(=C3)Br)OCC#C)OC)SC2=O

InChI

InChI=1S/C21H16BrNO5S/c1-4-9-28-19-14(22)10-13(11-17(19)27-3)12-18-20(24)23(21(25)29-18)15-7-5-6-8-16(15)26-2/h1,5-8,10-12H,9H2,2-3H3