2-methylsulfonyl-5-pentan-2-ylsulfinyl-1,3,4-thiadiazole

Systemtic Name: 2-methylsulfonyl-5-pentan-2-ylsulfinyl-1,3,4-thiadiazole Openeye Name: 2-(1-methylbutylsulfinyl)-5-methylsulfonyl-1,3,4-thiadiazole CAS Name: 2-methylsulfonyl-5-pentan-2-ylsulfinyl-1,3,4-thiadiazole IUPAC Name: 2-methylsulfonyl-5-pentan-2-ylsulfinyl-1,3,4-thiadiazole Traditional Name: 2-mesyl-5-(1-methylbutylsulfinyl)-1,3,4-thiadiazole Formula: C8H14N2O3S3 MolecularWeight: 282.40336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)S(=O)C1=NN=C(S1)S(=O)(=O)C

Isomeric SMILES

CCCC(C)S(=O)C1=NN=C(S1)S(=O)(=O)C

InChI

InChI=1S/C8H14N2O3S3/c1-4-5-6(2)15(11)7-9-10-8(14-7)16(3,12)13/h6H,4-5H2,1-3H3