COc1cc(S(C)=O)ccc1-c1nc2c[nH][nH]c(=O)c-2n1
Name: 2-(2-methoxy-4-methylsulfinyl-phenyl)-5H-imidazo[4,5-d]pyridazin-4-one
IUPAC: 2-(2-methoxy-4-methylsulfinylphenyl)-3,6-dihydroimidazo[4,5-d]pyridazin-1-ium-7-one
SMILES: COc1cc(S(C)=O)ccc1-c1nc2c[nH][nH]c(=O)c-2n1
Canonical SMILES: COC1=C(C=CC(=C1)S(=O)C)C2=[NH+]C3=C(N2)C=NNC3=O
Summenformel: C13H13N4O3S+
Molare Masse: 305.33
InChIKey: JHULKVSYBKQGNZ-UHFFFAOYSA-O
InChI: InChI=1S/C13H12N4O3S/c1-20-10-5-7(21(2)19)3-4-8(10)12-15-9-6-14-17-13(18)11(9)16-12/h3-6H,1-2H3,(H,15,16)(H,17,18)/p+1
PubChem CID: 173403584 →

Synonyme

SCHEMBL10686490

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