3-(3,5-dimethylpyrazol-1-yl)-6-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]pyridazine

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]pyridazine Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]pyridazine CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-6-[(2-methoxy-5-methylphenyl)methylthio]pyridazine IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[(2-methoxy-5-methylphenyl)methylsulfanyl]pyridazine Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[(2-methoxy-5-methyl-benzyl)thio]pyridazine Formula: C18H20N4OS MolecularWeight: 340.4426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NN=C(C=C2)N3C(=CC(=N3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NN=C(C=C2)N3C(=CC(=N3)C)C

InChI

InChI=1S/C18H20N4OS/c1-12-5-6-16(23-4)15(9-12)11-24-18-8-7-17(19-20-18)22-14(3)10-13(2)21-22/h5-10H,11H2,1-4H3