1,1-bis(oxidanylidene)-2-[2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethyl]-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-[2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethyl]-1,2-benzothiazol-3-one Openeye Name: 1,1-dioxo-2-[2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]ethyl]-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-[2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]ethyl]-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-[2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethyl]-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[2-[(5-piperidinosulfonyl-2-pyridyl)thio]ethyl]-1,2-benzothiazol-3-one Formula: C19H21N3O5S3 MolecularWeight: 467.58214

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCCN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCCN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C19H21N3O5S3/c23-19-16-6-2-3-7-17(16)30(26,27)22(19)12-13-28-18-9-8-15(14-20-18)29(24,25)21-10-4-1-5-11-21/h2-3,6-9,14H,1,4-5,10-13H2