3-[2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]ethyl]-1,3-benzoxazol-2-one CAS Name: 3-[2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]ethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethyl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[(5-piperidinosulfonyl-2-pyridyl)thio]ethyl]-1,3-benzoxazol-2-one Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C19H21N3O4S2/c23-19-22(16-6-2-3-7-17(16)26-19)12-13-27-18-9-8-15(14-20-18)28(24,25)21-10-4-1-5-11-21/h2-3,6-9,14H,1,4-5,10-13H2