(5E)-5-[[3-(3-bromanyl-4-ethoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-methyl-1,3-thiazolidine-2,4-dione

Systemtic Name: (5E)-5-[[3-(3-bromanyl-4-ethoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-methyl-1,3-thiazolidine-2,4-dione Openeye Name: (5E)-5-[[3-(3-bromo-4-ethoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-methyl-thiazolidine-2,4-dione CAS Name: (5E)-5-[[3-(3-bromo-4-ethoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-methylthiazolidine-2,4-dione IUPAC Name: (5E)-5-[[3-(3-bromo-4-ethoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-methyl-1,3-thiazolidine-2,4-dione Traditional Name: (5E)-5-[[3-(3-bromo-4-ethoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-methyl-thiazolidine-2,4-quinone Formula: C22H18BrN3O3S MolecularWeight: 484.36562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=O)S3)C)C4=CC=CC=C4)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C/3\C(=O)N(C(=O)S3)C)C4=CC=CC=C4)Br

InChI

InChI=1S/C22H18BrN3O3S/c1-3-29-18-10-9-14(11-17(18)23)20-15(12-19-21(27)25(2)22(28)30-19)13-26(24-20)16-7-5-4-6-8-16/h4-13H,3H2,1-2H3/b19-12+