3-tert-butyl-4-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-tert-butyl-4-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(Z)-(3-benzyloxyphenyl)methyleneamino]-3-tert-butyl-1H-1,2,4-triazole-5-thione CAS Name: 3-tert-butyl-4-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-tert-butyl-4-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(Z)-(3-benzoxybenzylidene)amino]-3-tert-butyl-1H-1,2,4-triazole-5-thione Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC(=S)N1N=CC2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NNC(=S)N1/N=C\C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-20(2,3)18-22-23-19(26)24(18)21-13-16-10-7-11-17(12-16)25-14-15-8-5-4-6-9-15/h4-13H,14H2,1-3H3,(H,23,26)/b21-13-