3-(4-imidazol-1-ylphenyl)-6-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyridazine

Systemtic Name: 3-(4-imidazol-1-ylphenyl)-6-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyridazine Openeye Name: 3-(4-imidazol-1-ylphenyl)-6-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyridazine CAS Name: 3-[4-(1-imidazolyl)phenyl]-6-[[4-(trifluoromethyl)phenyl]methylthio]pyridazine IUPAC Name: 3-(4-imidazol-1-ylphenyl)-6-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyridazine Traditional Name: 3-(4-imidazol-1-ylphenyl)-6-[[4-(trifluoromethyl)benzyl]thio]pyridazine Formula: C21H15F3N4S MolecularWeight: 412.43081

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN=C(C=C2)C3=CC=C(C=C3)N4C=CN=C4)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN=C(C=C2)C3=CC=C(C=C3)N4C=CN=C4)C(F)(F)F

InChI

InChI=1S/C21H15F3N4S/c22-21(23,24)17-5-1-15(2-6-17)13-29-20-10-9-19(26-27-20)16-3-7-18(8-4-16)28-12-11-25-14-28/h1-12,14H,13H2