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

Systemtic Name: 4-[(E)-[3-ethoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(3-ethoxy-4-isobutoxy-phenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-[3-ethoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-[3-ethoxy-4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(3-ethoxy-4-isobutoxy-benzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C15H20N4O2S MolecularWeight: 320.4099

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NN2C=NNC2=S)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/N2C=NNC2=S)OCC(C)C

InChI

InChI=1S/C15H20N4O2S/c1-4-20-14-7-12(5-6-13(14)21-9-11(2)3)8-17-19-10-16-18-15(19)22/h5-8,10-11H,4,9H2,1-3H3,(H,18,22)/b17-8+