(5Z)-5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-3-(2-morpholin-4-ium-4-ylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5Z)-5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-3-(2-morpholin-4-ium-4-ylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5Z)-5-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-3-(2-morpholin-4-ium-4-ylethyl)-2-thioxo-thiazolidin-4-one CAS Name: (5Z)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-[2-(4-morpholin-4-iumyl)ethyl]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5Z)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-(2-morpholin-4-ium-4-ylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5Z)-5-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-3-(2-morpholin-4-ium-4-ylethyl)-2-thioxo-thiazolidin-4-one Formula: C17H20BrN2O4S2+ MolecularWeight: 460.3857

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC[NH+]3CCOCC3)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CC[NH+]3CCOCC3)Br)O

InChI

InChI=1S/C17H19BrN2O4S2/c1-23-13-9-11(8-12(18)15(13)21)10-14-16(22)20(17(25)26-14)3-2-19-4-6-24-7-5-19/h8-10,21H,2-7H2,1H3/p+1/b14-10-