4-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylideneamino]-3-ethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylideneamino]-3-ethyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyleneamino]-3-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]-3-ethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]-3-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-[4-(4-chlorobenzyl)oxy-3-ethoxy-benzylidene]amino]-3-ethyl-1H-1,2,4-triazole-5-thione Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1N=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OCC

Isomeric SMILES

CCC1=NNC(=S)N1/N=C/C2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OCC

InChI

InChI=1S/C20H21ClN4O2S/c1-3-19-23-24-20(28)25(19)22-12-15-7-10-17(18(11-15)26-4-2)27-13-14-5-8-16(21)9-6-14/h5-12H,3-4,13H2,1-2H3,(H,24,28)/b22-12+