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

Systemtic Name: 3-methyl-4-[(E)-[4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(4-isobutoxyphenyl)methyleneamino]-3-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-methyl-4-[(E)-[4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-methyl-4-[(E)-[4-(2-methylpropoxy)phenyl]methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(4-isobutoxybenzylidene)amino]-3-methyl-1H-1,2,4-triazole-5-thione Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1N=CC2=CC=C(C=C2)OCC(C)C

Isomeric SMILES

CC1=NNC(=S)N1/N=C/C2=CC=C(C=C2)OCC(C)C

InChI

InChI=1S/C14H18N4OS/c1-10(2)9-19-13-6-4-12(5-7-13)8-15-18-11(3)16-17-14(18)20/h4-8,10H,9H2,1-3H3,(H,17,20)/b15-8+