2-methyl-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazine-5,6-dione

Systemtic Name: 2-methyl-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazine-5,6-dione Openeye Name: 2-methyl-3-(4-pyridylmethylsulfanyl)-1H-1,2,4-triazine-5,6-dione CAS Name: 2-methyl-3-(pyridin-4-ylmethylthio)-1H-1,2,4-triazine-5,6-dione IUPAC Name: 2-methyl-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazine-5,6-dione Traditional Name: 2-methyl-3-(4-pyridylmethylthio)-1H-1,2,4-triazine-5,6-quinone Formula: C10H10N4O2S MolecularWeight: 250.277

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=O)C(=O)N1)SCC2=CC=NC=C2

Isomeric SMILES

CN1C(=NC(=O)C(=O)N1)SCC2=CC=NC=C2

InChI

InChI=1S/C10H10N4O2S/c1-14-10(12-8(15)9(16)13-14)17-6-7-2-4-11-5-3-7/h2-5H,6H2,1H3,(H,13,16)