[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-3-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone

Systemtic Name: [1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-3-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Openeye Name: [1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-piperidyl]-[4-(1-piperidyl)-1-piperidyl]methanone CAS Name: [1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-piperidinyl]-[4-(1-piperidinyl)-1-piperidinyl]methanone IUPAC Name: [1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-3-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Traditional Name: (1-piazthiol-4-ylsulfonyl-3-piperidyl)-(4-piperidinopiperidino)methanone Formula: C22H31N5O3S2 MolecularWeight: 477.64324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C22H31N5O3S2/c28-22(26-14-9-18(10-15-26)25-11-2-1-3-12-25)17-6-5-13-27(16-17)32(29,30)20-8-4-7-19-21(20)24-31-23-19/h4,7-8,17-18H,1-3,5-6,9-16H2