3-(3,5-dimethylpyrazol-1-yl)-6-[(2-phenoxyphenyl)methylsulfanyl]pyridazine

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[(2-phenoxyphenyl)methylsulfanyl]pyridazine Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[(2-phenoxyphenyl)methylsulfanyl]pyridazine CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-6-[(2-phenoxyphenyl)methylthio]pyridazine IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[(2-phenoxyphenyl)methylsulfanyl]pyridazine Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[(2-phenoxybenzyl)thio]pyridazine Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC=CC=C3OC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC=CC=C3OC4=CC=CC=C4)C

InChI

InChI=1S/C22H20N4OS/c1-16-14-17(2)26(25-16)21-12-13-22(24-23-21)28-15-18-8-6-7-11-20(18)27-19-9-4-3-5-10-19/h3-14H,15H2,1-2H3