4-[(E)-(2-methoxyphenyl)methylideneamino]-3-(3-oxidanylbutyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(2-methoxyphenyl)methylideneamino]-3-(3-oxidanylbutyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(3-hydroxybutyl)-4-[(E)-(2-methoxyphenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(3-hydroxybutyl)-4-[(E)-(2-methoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(3-hydroxybutyl)-4-[(E)-(2-methoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(3-hydroxybutyl)-4-[(E)-o-anisylideneamino]-1H-1,2,4-triazole-5-thione Formula: C14H18N4O2S MolecularWeight: 306.38332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=NNC(=S)N1N=CC2=CC=CC=C2OC)O

Isomeric SMILES

CC(CCC1=NNC(=S)N1/N=C/C2=CC=CC=C2OC)O

InChI

InChI=1S/C14H18N4O2S/c1-10(19)7-8-13-16-17-14(21)18(13)15-9-11-5-3-4-6-12(11)20-2/h3-6,9-10,19H,7-8H2,1-2H3,(H,17,21)/b15-9+