3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole

Systemtic Name: 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole Openeye Name: 3-(2,3-dihydrobenzofuran-5-yl)-5-(5-isobutyl-1H-1,2,4-triazol-3-yl)-1H-indazole CAS Name: 3-(2,3-dihydrobenzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole IUPAC Name: 3-(2,3-dihydro-1-benzofuran-5-yl)-5-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]-1H-indazole Traditional Name: 3-coumaran-5-yl-5-(5-isobutyl-1H-1,2,4-triazol-3-yl)-1H-indazole Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=NN1)C2=CC3=C(C=C2)NN=C3C4=CC5=C(C=C4)OCC5

Isomeric SMILES

CC(C)CC1=NC(=NN1)C2=CC3=C(C=C2)NN=C3C4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C21H21N5O/c1-12(2)9-19-22-21(26-24-19)15-3-5-17-16(11-15)20(25-23-17)14-4-6-18-13(10-14)7-8-27-18/h3-6,10-12H,7-9H2,1-2H3,(H,23,25)(H,22,24,26)