1-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone Openeye Name: 1-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethanone Traditional Name: 1-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]ethanone Formula: C20H23N3O3S3 MolecularWeight: 449.60992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)N3CCSC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)N3CCSC4=CC=CC=C43

InChI

InChI=1S/C20H23N3O3S3/c24-20(23-12-13-27-18-7-3-2-6-17(18)23)15-28-19-9-8-16(14-21-19)29(25,26)22-10-4-1-5-11-22/h2-3,6-9,14H,1,4-5,10-13,15H2