2-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]-1,3-benzothiazole

Systemtic Name: 2-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]-1,3-benzothiazole Openeye Name: 2-[(3S)-1-(benzenesulfonyl)-3-piperidyl]-1,3-benzothiazole CAS Name: 2-[(3S)-1-(benzenesulfonyl)-3-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[(3S)-1-(benzenesulfonyl)piperidin-3-yl]-1,3-benzothiazole Traditional Name: 2-[(3S)-1-besyl-3-piperidyl]-1,3-benzothiazole Formula: C18H18N2O2S2 MolecularWeight: 358.47772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H18N2O2S2/c21-24(22,15-8-2-1-3-9-15)20-12-6-7-14(13-20)18-19-16-10-4-5-11-17(16)23-18/h1-5,8-11,14H,6-7,12-13H2/t14-/m0/s1