5-[(2-prop-2-enylphenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione

Systemtic Name: 5-[(2-prop-2-enylphenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione Openeye Name: 5-[(2-allylphenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione CAS Name: 5-[(2-prop-2-enylphenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione IUPAC Name: 5-[(2-prop-2-enylphenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione Traditional Name: 5-[(2-allylphenoxy)methyl]-1,2-dihydro-1,2,4-triazole-3-thione Formula: C12H13N3OS MolecularWeight: 247.31612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC2=NC(=S)NN2

Isomeric SMILES

C=CCC1=CC=CC=C1OCC2=NC(=S)NN2

InChI

InChI=1S/C12H13N3OS/c1-2-5-9-6-3-4-7-10(9)16-8-11-13-12(17)15-14-11/h2-4,6-7H,1,5,8H2,(H2,13,14,15,17)