4-[(Z)-(3-ethoxy-4-methoxy-phenyl)methylideneamino]-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(Z)-(3-ethoxy-4-methoxy-phenyl)methylideneamino]-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzylsulfanyl-4-[(Z)-(3-ethoxy-4-methoxy-phenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(Z)-(3-ethoxy-4-methoxyphenyl)methylideneamino]-3-(phenylmethylthio)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzylsulfanyl-4-[(Z)-(3-ethoxy-4-methoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(benzylthio)-4-[(Z)-(3-ethoxy-4-methoxy-benzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NN2C(=S)NN=C2SCC3=CC=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N\N2C(=S)NN=C2SCC3=CC=CC=C3)OC

InChI

InChI=1S/C19H20N4O2S2/c1-3-25-17-11-15(9-10-16(17)24-2)12-20-23-18(26)21-22-19(23)27-13-14-7-5-4-6-8-14/h4-12H,3,13H2,1-2H3,(H,21,26)/b20-12-