3-[4-[3-[1-(phenylsulfonyl)cyclobutyl]propyl]piperazin-1-yl]-1,2-benzothiazole

Systemtic Name: 3-[4-[3-[1-(phenylsulfonyl)cyclobutyl]propyl]piperazin-1-yl]-1,2-benzothiazole Openeye Name: 3-[4-[3-[1-(benzenesulfonyl)cyclobutyl]propyl]piperazin-1-yl]-1,2-benzothiazole CAS Name: 3-[4-[3-[1-(benzenesulfonyl)cyclobutyl]propyl]-1-piperazinyl]-1,2-benzothiazole IUPAC Name: 3-[4-[3-[1-(benzenesulfonyl)cyclobutyl]propyl]piperazin-1-yl]-1,2-benzothiazole Traditional Name: 3-[4-[3-(1-besylcyclobutyl)propyl]piperazino]-1,2-benzothiazole Formula: C24H29N3O2S2 MolecularWeight: 455.63596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(CCCN2CCN(CC2)C3=NSC4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CC(C1)(CCCN2CCN(CC2)C3=NSC4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H29N3O2S2/c28-31(29,20-8-2-1-3-9-20)24(12-6-13-24)14-7-15-26-16-18-27(19-17-26)23-21-10-4-5-11-22(21)30-25-23/h1-5,8-11H,6-7,12-19H2