3-(2-ethoxyphenyl)-4-[(Z)-(2-ethyl-1-benzofuran-3-yl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2-ethoxyphenyl)-4-[(Z)-(2-ethyl-1-benzofuran-3-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2-ethoxyphenyl)-4-[(Z)-(2-ethylbenzofuran-3-yl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-ethoxyphenyl)-4-[(Z)-(2-ethyl-3-benzofuranyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-ethoxyphenyl)-4-[(Z)-(2-ethyl-1-benzofuran-3-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(Z)-(2-ethylbenzofuran-3-yl)methyleneamino]-3-o-phenetyl-1H-1,2,4-triazole-5-thione Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=NN3C(=NNC3=S)C4=CC=CC=C4OCC

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=N\N3C(=NNC3=S)C4=CC=CC=C4OCC

InChI

InChI=1S/C21H20N4O2S/c1-3-17-16(14-9-5-8-12-19(14)27-17)13-22-25-20(23-24-21(25)28)15-10-6-7-11-18(15)26-4-2/h5-13H,3-4H2,1-2H3,(H,24,28)/b22-13-