2-(furan-2-ylmethylsulfinyl)-N-[(Z)-2-oxidanyl-4-[4-(piperidin-4-ylmethyl)pyridin-2-yl]but-1-enyl]ethanamide

Systemtic Name: 2-(furan-2-ylmethylsulfinyl)-N-[(Z)-2-oxidanyl-4-[4-(piperidin-4-ylmethyl)pyridin-2-yl]but-1-enyl]ethanamide Openeye Name: 2-(2-furylmethylsulfinyl)-N-[(Z)-2-hydroxy-4-[4-(4-piperidylmethyl)-2-pyridyl]but-1-enyl]acetamide CAS Name: 2-(2-furanylmethylsulfinyl)-N-[(Z)-2-hydroxy-4-[4-(4-piperidinylmethyl)-2-pyridinyl]but-1-enyl]acetamide IUPAC Name: 2-(furan-2-ylmethylsulfinyl)-N-[(Z)-2-hydroxy-4-[4-(piperidin-4-ylmethyl)pyridin-2-yl]but-1-enyl]acetamide Traditional Name: 2-(2-furfurylsulfinyl)-N-[(Z)-2-hydroxy-4-[4-(4-piperidylmethyl)-2-pyridyl]but-1-enyl]acetamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CC2=CC(=NC=C2)CCC(=CNC(=O)CS(=O)CC3=CC=CO3)O

Isomeric SMILES

C1CNCCC1CC2=CC(=NC=C2)CC/C(=C/NC(=O)CS(=O)CC3=CC=CO3)/O

InChI

InChI=1S/C22H29N3O4S/c26-20(14-25-22(27)16-30(28)15-21-2-1-11-29-21)4-3-19-13-18(7-10-24-19)12-17-5-8-23-9-6-17/h1-2,7,10-11,13-14,17,23,26H,3-6,8-9,12,15-16H2,(H,25,27)/b20-14-