2-[(5E)-5-[4-acetyloxy-1-(4-bromophenyl)butylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid

Systemtic Name: 2-[(5E)-5-[4-acetyloxy-1-(4-bromophenyl)butylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid Openeye Name: 2-[(5E)-5-[4-acetoxy-1-(4-bromophenyl)butylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetic acid CAS Name: 2-[(5E)-5-[4-acetyloxy-1-(4-bromophenyl)butylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid IUPAC Name: 2-[(5E)-5-[4-acetyloxy-1-(4-bromophenyl)butylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid Traditional Name: 2-[(5E)-5-[4-acetoxy-1-(4-bromophenyl)butylidene]-4-keto-2-thioxo-thiazolidin-3-yl]acetic acid Formula: C17H16BrNO5S2 MolecularWeight: 458.34664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCC(=C1C(=O)N(C(=S)S1)CC(=O)O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(=O)OCCC/C(=C\1/C(=O)N(C(=S)S1)CC(=O)O)/C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H16BrNO5S2/c1-10(20)24-8-2-3-13(11-4-6-12(18)7-5-11)15-16(23)19(9-14(21)22)17(25)26-15/h4-7H,2-3,8-9H2,1H3,(H,21,22)/b15-13+