4-[(5Z)-5-[(3-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-methoxyphenyl)butanamide

Systemtic Name: 4-[(5Z)-5-[(3-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-methoxyphenyl)butanamide Openeye Name: 4-[(5Z)-5-[(3-bromophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-N-(2-methoxyphenyl)butanamide CAS Name: 4-[(5Z)-5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-N-(2-methoxyphenyl)butanamide IUPAC Name: 4-[(5Z)-5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-methoxyphenyl)butanamide Traditional Name: 4-[(5Z)-5-(3-bromobenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-N-(2-methoxyphenyl)butyramide Formula: C21H19BrN2O3S2 MolecularWeight: 491.42116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CCCN2C(=O)C(=CC3=CC(=CC=C3)Br)SC2=S

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CCCN2C(=O)/C(=C/C3=CC(=CC=C3)Br)/SC2=S

InChI

InChI=1S/C21H19BrN2O3S2/c1-27-17-9-3-2-8-16(17)23-19(25)10-5-11-24-20(26)18(29-21(24)28)13-14-6-4-7-15(22)12-14/h2-4,6-9,12-13H,5,10-11H2,1H3,(H,23,25)/b18-13-