3-(4,6-dimethoxypyrimidin-2-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(4,6-dimethoxypyrimidin-2-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-(4,6-dimethoxypyrimidin-2-yl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(4,6-dimethoxy-2-pyrimidinyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4,6-dimethoxypyrimidin-2-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-(4,6-dimethoxypyrimidin-2-yl)-1H-1,2,4-triazole-5-thione Formula: C11H13N5O2S MolecularWeight: 279.31822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C2=NNC(=S)N2CC=C)OC

Isomeric SMILES

COC1=CC(=NC(=N1)C2=NNC(=S)N2CC=C)OC

InChI

InChI=1S/C11H13N5O2S/c1-4-5-16-10(14-15-11(16)19)9-12-7(17-2)6-8(13-9)18-3/h4,6H,1,5H2,2-3H3,(H,15,19)