3-[2-(dioxidanyl)prop-2-enyl]-4-methyl-1,4-dihydropyrazole-5-thione

Systemtic Name: 3-[2-(dioxidanyl)prop-2-enyl]-4-methyl-1,4-dihydropyrazole-5-thione Openeye Name: 3-(2-hydroperoxyallyl)-4-methyl-1,4-dihydropyrazole-5-thione CAS Name: 3-(2-hydroperoxyprop-2-enyl)-4-methyl-1,4-dihydropyrazole-5-thione IUPAC Name: 3-(2-hydroperoxyprop-2-enyl)-4-methyl-1,4-dihydropyrazole-5-thione Traditional Name: 5-(2-hydroperoxyallyl)-4-methyl-2-pyrazoline-3-thione Formula: C7H10N2O2S MolecularWeight: 186.2315

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NNC1=S)CC(=C)OO

Isomeric SMILES

CC1C(=NNC1=S)CC(=C)OO

InChI

InChI=1S/C7H10N2O2S/c1-4(11-10)3-6-5(2)7(12)9-8-6/h5,10H,1,3H2,2H3,(H,9,12)