5-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]-3-(3-pyridylmethyl)-2-thioxo-thiazolidin-4-one CAS Name: 5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-3-(3-pyridinylmethyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-(4-hydroxy-3-methoxy-5-nitro-benzylidene)-3-(3-pyridylmethyl)-2-thioxo-thiazolidin-4-one Formula: C17H13N3O5S2 MolecularWeight: 403.43222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2C(=O)N(C(=S)S2)CC3=CN=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2C(=O)N(C(=S)S2)CC3=CN=CC=C3

InChI

InChI=1S/C17H13N3O5S2/c1-25-13-6-11(5-12(15(13)21)20(23)24)7-14-16(22)19(17(26)27-14)9-10-3-2-4-18-8-10/h2-8,21H,9H2,1H3