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

Systemtic Name: 4-[(E)-[4-(2-methylpropoxy)phenyl]methylideneamino]-3-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(4-isobutoxyphenyl)methyleneamino]-3-propyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-[4-(2-methylpropoxy)phenyl]methylideneamino]-3-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-[4-(2-methylpropoxy)phenyl]methylideneamino]-3-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(4-isobutoxybenzylidene)amino]-3-propyl-1H-1,2,4-triazole-5-thione Formula: C16H22N4OS MolecularWeight: 318.43708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1N=CC2=CC=C(C=C2)OCC(C)C

Isomeric SMILES

CCCC1=NNC(=S)N1/N=C/C2=CC=C(C=C2)OCC(C)C

InChI

InChI=1S/C16H22N4OS/c1-4-5-15-18-19-16(22)20(15)17-10-13-6-8-14(9-7-13)21-11-12(2)3/h6-10,12H,4-5,11H2,1-3H3,(H,19,22)/b17-10+