3-[(2,5-dimethylphenyl)methylsulfanyl]-6-(3,4,5-trimethoxyphenyl)pyridazine

Systemtic Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-6-(3,4,5-trimethoxyphenyl)pyridazine Openeye Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-6-(3,4,5-trimethoxyphenyl)pyridazine CAS Name: 3-[(2,5-dimethylphenyl)methylthio]-6-(3,4,5-trimethoxyphenyl)pyridazine IUPAC Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-6-(3,4,5-trimethoxyphenyl)pyridazine Traditional Name: 3-[(2,5-dimethylbenzyl)thio]-6-(3,4,5-trimethoxyphenyl)pyridazine Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NN=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NN=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H24N2O3S/c1-14-6-7-15(2)17(10-14)13-28-21-9-8-18(23-24-21)16-11-19(25-3)22(27-5)20(12-16)26-4/h6-12H,13H2,1-5H3