5-[(3-bromanyl-5-nitro-2-oxidanyl-phenyl)methylidene]-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[(3-bromanyl-5-nitro-2-oxidanyl-phenyl)methylidene]-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-benzyl-5-[(3-bromo-2-hydroxy-5-nitro-phenyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: 5-[(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]-3-(phenylmethyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-benzyl-5-[(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-benzyl-5-(3-bromo-2-hydroxy-5-nitro-benzylidene)-2-thioxo-thiazolidin-4-one Formula: C17H11BrN2O4S2 MolecularWeight: 451.31424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C(=CC3=CC(=CC(=C3O)Br)[N+](=O)[O-])SC2=S

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C(=CC3=CC(=CC(=C3O)Br)[N+](=O)[O-])SC2=S

InChI

InChI=1S/C17H11BrN2O4S2/c18-13-8-12(20(23)24)6-11(15(13)21)7-14-16(22)19(17(25)26-14)9-10-4-2-1-3-5-10/h1-8,21H,9H2