3-[4-[bis(fluoranyl)methoxy]phenyl]-4-[(4-tert-butylphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[4-[bis(fluoranyl)methoxy]phenyl]-4-[(4-tert-butylphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(4-tert-butylphenyl)methyleneamino]-3-[4-(difluoromethoxy)phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(4-tert-butylphenyl)methylideneamino]-3-[4-(difluoromethoxy)phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(4-tert-butylphenyl)methylideneamino]-3-[4-(difluoromethoxy)phenyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(4-tert-butylbenzylidene)amino]-3-[4-(difluoromethoxy)phenyl]-1H-1,2,4-triazole-5-thione Formula: C20H20F2N4OS MolecularWeight: 402.460806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)OC(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C20H20F2N4OS/c1-20(2,3)15-8-4-13(5-9-15)12-23-26-17(24-25-19(26)28)14-6-10-16(11-7-14)27-18(21)22/h4-12,18H,1-3H3,(H,25,28)