1-[bis(fluoranyl)methylsulfanyl]-4-(3,4-dimethylphenyl)phthalazine

Systemtic Name: 1-[bis(fluoranyl)methylsulfanyl]-4-(3,4-dimethylphenyl)phthalazine Openeye Name: 1-(difluoromethylsulfanyl)-4-(3,4-dimethylphenyl)phthalazine CAS Name: 1-(difluoromethylthio)-4-(3,4-dimethylphenyl)phthalazine IUPAC Name: 1-(difluoromethylsulfanyl)-4-(3,4-dimethylphenyl)phthalazine Traditional Name: 1-(difluoromethylthio)-4-(3,4-dimethylphenyl)phthalazine Formula: C17H14F2N2S MolecularWeight: 316.368266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC(F)F)C

InChI

InChI=1S/C17H14F2N2S/c1-10-7-8-12(9-11(10)2)15-13-5-3-4-6-14(13)16(21-20-15)22-17(18)19/h3-9,17H,1-2H3