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

Systemtic Name: 2-(4-methoxy-2-methylsulfanyl-phenyl)-1H-imidazo[4,5-d]pyridazine Openeye Name: 2-(4-methoxy-2-methylsulfanyl-phenyl)-1H-imidazo[4,5-d]pyridazine CAS Name: 2-[4-methoxy-2-(methylthio)phenyl]-1H-imidazo[4,5-d]pyridazine IUPAC Name: 2-(4-methoxy-2-methylsulfanylphenyl)-1H-imidazo[4,5-d]pyridazine Traditional Name: 2-[4-methoxy-2-(methylthio)phenyl]-1H-imidazo[4,5-d]pyridazine Formula: C13H12N4OS MolecularWeight: 272.32558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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