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

Systemtic Name: 5-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-3-phenyl-1,3-thiazolidine-2,4-dione Openeye Name: 5-[(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-3-phenyl-thiazolidine-2,4-dione CAS Name: 5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-phenylthiazolidine-2,4-dione IUPAC Name: 5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-phenyl-1,3-thiazolidine-2,4-dione Traditional Name: 5-(3-bromo-5-methoxy-4-propargyloxy-benzylidene)-3-phenyl-thiazolidine-2,4-quinone Formula: C20H14BrNO4S MolecularWeight: 444.29846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14BrNO4S/c1-3-9-26-18-15(21)10-13(11-16(18)25-2)12-17-19(23)22(20(24)27-17)14-7-5-4-6-8-14/h1,4-8,10-12H,9H2,2H3