3-(4-tert-butylphenyl)-5-(furan-2-yl)-1H-1,2,4-triazole

Systemtic Name: 3-(4-tert-butylphenyl)-5-(furan-2-yl)-1H-1,2,4-triazole Openeye Name: 3-(4-tert-butylphenyl)-5-(2-furyl)-1H-1,2,4-triazole CAS Name: 3-(4-tert-butylphenyl)-5-(2-furanyl)-1H-1,2,4-triazole IUPAC Name: 3-(4-tert-butylphenyl)-5-(furan-2-yl)-1H-1,2,4-triazole Traditional Name: 3-(4-tert-butylphenyl)-5-(2-furyl)-1H-1,2,4-triazole Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=N2)C3=CC=CO3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=N2)C3=CC=CO3

InChI

InChI=1S/C16H17N3O/c1-16(2,3)12-8-6-11(7-9-12)14-17-15(19-18-14)13-5-4-10-20-13/h4-10H,1-3H3,(H,17,18,19)