ethyl 2-[(5E)-5-[[1-(4-bromanyl-3-chloranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[(5E)-5-[[1-(4-bromanyl-3-chloranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethanoate Openeye Name: ethyl 2-[(5E)-5-[[1-(4-bromo-3-chloro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-2,4-dioxo-thiazolidin-3-yl]acetate CAS Name: 2-[(5E)-5-[[1-(4-bromo-3-chlorophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-2,4-dioxo-3-thiazolidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(5E)-5-[[1-(4-bromo-3-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[(5E)-5-[[1-(4-bromo-3-chloro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-2,4-diketo-thiazolidin-3-yl]acetic acid ethyl ester Formula: C20H18BrClN2O4S MolecularWeight: 497.78992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC(=C(C=C3)Br)Cl)C)SC1=O

Isomeric SMILES

CCOC(=O)CN1C(=O)/C(=C\C2=C(N(C(=C2)C)C3=CC(=C(C=C3)Br)Cl)C)/SC1=O

InChI

InChI=1S/C20H18BrClN2O4S/c1-4-28-18(25)10-23-19(26)17(29-20(23)27)8-13-7-11(2)24(12(13)3)14-5-6-15(21)16(22)9-14/h5-9H,4,10H2,1-3H3/b17-8+