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

Systemtic Name: 2-(2-methoxy-4-methylsulfonyl-phenyl)-1H-imidazo[4,5-d]pyridazine Openeye Name: 2-(2-methoxy-4-methylsulfonyl-phenyl)-1H-imidazo[4,5-d]pyridazine CAS Name: 2-(2-methoxy-4-methylsulfonylphenyl)-1H-imidazo[4,5-d]pyridazine IUPAC Name: 2-(2-methoxy-4-methylsulfonylphenyl)-1H-imidazo[4,5-d]pyridazine Traditional Name: 2-(4-mesyl-2-methoxy-phenyl)-1H-imidazo[4,5-d]pyridazine Formula: C13H12N4O3S MolecularWeight: 304.32438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4O3S/c1-20-12-5-8(21(2,18)19)3-4-9(12)13-16-10-6-14-15-7-11(10)17-13/h3-7H,1-2H3,(H,16,17)