4-ethoxy-2-(4-nitrophenyl)-5-sulfanyl-pyridazin-3-one

Systemtic Name: 4-ethoxy-2-(4-nitrophenyl)-5-sulfanyl-pyridazin-3-one Openeye Name: 4-ethoxy-2-(4-nitrophenyl)-5-sulfanyl-pyridazin-3-one CAS Name: 4-ethoxy-5-mercapto-2-(4-nitrophenyl)-3-pyridazinone IUPAC Name: 4-ethoxy-2-(4-nitrophenyl)-5-sulfanylpyridazin-3-one Traditional Name: 4-ethoxy-5-mercapto-2-(4-nitrophenyl)pyridazin-3-one Formula: C12H11N3O4S MolecularWeight: 293.29844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])S

Isomeric SMILES

CCOC1=C(C=NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])S

InChI

InChI=1S/C12H11N3O4S/c1-2-19-11-10(20)7-13-14(12(11)16)8-3-5-9(6-4-8)15(17)18/h3-7,20H,2H2,1H3