5-[5-(1-methylpyrazol-4-yl)-2-oxidanyl-phenyl]-1,1-bis(oxidanylidene)-1,2,5-thiadiazolidin-3-one

Systemtic Name: 5-[5-(1-methylpyrazol-4-yl)-2-oxidanyl-phenyl]-1,1-bis(oxidanylidene)-1,2,5-thiadiazolidin-3-one Openeye Name: 5-[2-hydroxy-5-(1-methylpyrazol-4-yl)phenyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one CAS Name: 5-[2-hydroxy-5-(1-methyl-4-pyrazolyl)phenyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one IUPAC Name: 5-[2-hydroxy-5-(1-methylpyrazol-4-yl)phenyl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one Traditional Name: 5-[2-hydroxy-5-(1-methylpyrazol-4-yl)phenyl]-1,1-diketo-1,2,5-thiadiazolidin-3-one Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CC(=C(C=C2)O)N3CC(=O)NS3(=O)=O

Isomeric SMILES

CN1C=C(C=N1)C2=CC(=C(C=C2)O)N3CC(=O)NS3(=O)=O

InChI

InChI=1S/C12H12N4O4S/c1-15-6-9(5-13-15)8-2-3-11(17)10(4-8)16-7-12(18)14-21(16,19)20/h2-6,17H,7H2,1H3,(H,14,18)