4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-2,1,3-benzothiadiazole

Systemtic Name: 4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-[[(3S,5S)-3,5-dimethyl-1-piperidyl]sulfonyl]-2,1,3-benzothiadiazole CAS Name: 4-[[(3S,5S)-3,5-dimethyl-1-piperidinyl]sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-[(3S,5S)-3,5-dimethylpiperidino]sulfonylpiazthiole Formula: C13H17N3O2S2 MolecularWeight: 311.42298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC3=NSN=C32)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC3=NSN=C32)C

InChI

InChI=1S/C13H17N3O2S2/c1-9-6-10(2)8-16(7-9)20(17,18)12-5-3-4-11-13(12)15-19-14-11/h3-5,9-10H,6-8H2,1-2H3/t9-,10-/m0/s1