2-(2-methoxy-4-methylsulfanyl-phenyl)-1H-imidazo[4,5-d]pyridazine hydrochloride

Systemtic Name: 2-(2-methoxy-4-methylsulfanyl-phenyl)-1H-imidazo[4,5-d]pyridazine hydrochloride Openeye Name: 2-(2-methoxy-4-methylsulfanyl-phenyl)-1H-imidazo[4,5-d]pyridazine hydrochloride CAS Name: 2-[2-methoxy-4-(methylthio)phenyl]-1H-imidazo[4,5-d]pyridazine hydrochloride IUPAC Name: 2-(2-methoxy-4-methylsulfanylphenyl)-1H-imidazo[4,5-d]pyridazine hydrochloride Traditional Name: 2-[2-methoxy-4-(methylthio)phenyl]-1H-imidazo[4,5-d]pyridazine hydrochloride Formula: C13H13ClN4OS MolecularWeight: 308.78652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C2=NC3=CN=NC=C3N2.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C2=NC3=CN=NC=C3N2.Cl

InChI

InChI=1S/C13H12N4OS.ClH/c1-18-12-5-8(19-2)3-4-9(12)13-16-10-6-14-15-7-11(10)17-13;/h3-7H,1-2H3,(H,16,17);1H