5-[3,5-ditert-butyl-4-(1-methoxyethoxymethoxy)phenyl]-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-[3,5-ditert-butyl-4-(1-methoxyethoxymethoxy)phenyl]-1H-1,2,4-triazol-3-amine Openeye Name: 5-[3,5-ditert-butyl-4-(1-methoxyethoxymethoxy)phenyl]-1H-1,2,4-triazol-3-amine CAS Name: 5-[3,5-ditert-butyl-4-(1-methoxyethoxymethoxy)phenyl]-1H-1,2,4-triazol-3-amine IUPAC Name: 5-[3,5-ditert-butyl-4-(1-methoxyethoxymethoxy)phenyl]-1H-1,2,4-triazol-3-amine Traditional Name: [5-[3,5-ditert-butyl-4-(1-methoxyethoxymethoxy)phenyl]-1H-1,2,4-triazol-3-yl]amine Formula: C20H32N4O3 MolecularWeight: 376.49308

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC)OCOC1=C(C=C(C=C1C(C)(C)C)C2=NC(=NN2)N)C(C)(C)C

Isomeric SMILES

CC(OC)OCOC1=C(C=C(C=C1C(C)(C)C)C2=NC(=NN2)N)C(C)(C)C

InChI

InChI=1S/C20H32N4O3/c1-12(25-8)26-11-27-16-14(19(2,3)4)9-13(10-15(16)20(5,6)7)17-22-18(21)24-23-17/h9-10,12H,11H2,1-8H3,(H3,21,22,23,24)