5-[[4-[(4-bromophenyl)methoxy]-3-chloranyl-5-methoxy-phenyl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[[4-[(4-bromophenyl)methoxy]-3-chloranyl-5-methoxy-phenyl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Openeye Name: 5-[[4-[(4-bromophenyl)methoxy]-3-chloro-5-methoxy-phenyl]methylene]-3-prop-2-ynyl-thiazolidine-2,4-dione CAS Name: 5-[[4-[(4-bromophenyl)methoxy]-3-chloro-5-methoxyphenyl]methylidene]-3-prop-2-ynylthiazolidine-2,4-dione IUPAC Name: 5-[[4-[(4-bromophenyl)methoxy]-3-chloro-5-methoxyphenyl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Traditional Name: 5-[4-(4-bromobenzyl)oxy-3-chloro-5-methoxy-benzylidene]-3-propargyl-thiazolidine-2,4-quinone Formula: C21H15BrClNO4S MolecularWeight: 492.7701

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC#C)Cl)OCC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC#C)Cl)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H15BrClNO4S/c1-3-8-24-20(25)18(29-21(24)26)11-14-9-16(23)19(17(10-14)27-2)28-12-13-4-6-15(22)7-5-13/h1,4-7,9-11H,8,12H2,2H3