N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[5-(1-piperidylsulfonyl)-1,3-benzoxazol-2-yl]sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[5-(1-piperidinylsulfonyl)-1,3-benzoxazol-2-yl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]acetamide Traditional Name: 2-[(5-piperidinosulfonyl-1,3-benzoxazol-2-yl)thio]-N-piperonyl-acetamide Formula: C22H23N3O6S2 MolecularWeight: 489.56452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H23N3O6S2/c26-21(23-12-15-4-6-19-20(10-15)30-14-29-19)13-32-22-24-17-11-16(5-7-18(17)31-22)33(27,28)25-8-2-1-3-9-25/h4-7,10-11H,1-3,8-9,12-14H2,(H,23,26)