N-(2,1,3-benzothiadiazol-4-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-piazthiol-4-yl-2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetamide Formula: C18H19N5O3S3 MolecularWeight: 449.57016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC=CC4=NSN=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H19N5O3S3/c24-16(20-14-5-4-6-15-18(14)22-28-21-15)12-27-17-8-7-13(11-19-17)29(25,26)23-9-2-1-3-10-23/h4-8,11H,1-3,9-10,12H2,(H,20,24)