(4-tert-butylphenyl)-[5-(furan-2-ylmethylamino)-3-(4-methylphenyl)-1,2,4-triazol-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[5-(furan-2-ylmethylamino)-3-(4-methylphenyl)-1,2,4-triazol-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[5-(2-furylmethylamino)-3-(p-tolyl)-1,2,4-triazol-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[5-(2-furanylmethylamino)-3-(4-methylphenyl)-1,2,4-triazol-1-yl]methanone IUPAC Name: (4-tert-butylphenyl)-[5-(furan-2-ylmethylamino)-3-(4-methylphenyl)-1,2,4-triazol-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[5-(2-furfurylamino)-3-(p-tolyl)-1,2,4-triazol-1-yl]methanone Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CO3)C(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CO3)C(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C25H26N4O2/c1-17-7-9-18(10-8-17)22-27-24(26-16-21-6-5-15-31-21)29(28-22)23(30)19-11-13-20(14-12-19)25(2,3)4/h5-15H,16H2,1-4H3,(H,26,27,28)