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

Systemtic Name: 4-[(Z)-(2-ethyl-1-benzofuran-3-yl)methylideneamino]-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzylsulfanyl-4-[(Z)-(2-ethylbenzofuran-3-yl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(Z)-(2-ethyl-3-benzofuranyl)methylideneamino]-3-(phenylmethylthio)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzylsulfanyl-4-[(Z)-(2-ethyl-1-benzofuran-3-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(benzylthio)-4-[(Z)-(2-ethylbenzofuran-3-yl)methyleneamino]-1H-1,2,4-triazole-5-thione Formula: C20H18N4OS2 MolecularWeight: 394.51312

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=NN3C(=S)NN=C3SCC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=N\N3C(=S)NN=C3SCC4=CC=CC=C4

InChI

InChI=1S/C20H18N4OS2/c1-2-17-16(15-10-6-7-11-18(15)25-17)12-21-24-19(26)22-23-20(24)27-13-14-8-4-3-5-9-14/h3-12H,2,13H2,1H3,(H,22,26)/b21-12-