N-[(E)-but-2-enyl]-6-(2-hydroxyethylsulfanyl)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxy-hexanamide

Systemtic Name: N-[(E)-but-2-enyl]-6-(2-hydroxyethylsulfanyl)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxy-hexanamide Openeye Name: N-[(E)-but-2-enyl]-6-(2-hydroxyethylsulfanyl)-4-[[4-(1-piperidylmethyl)-2-pyridyl]oxy]hexanamide CAS Name: N-[(E)-but-2-enyl]-6-(2-hydroxyethylthio)-4-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]hexanamide IUPAC Name: N-[(E)-but-2-enyl]-6-(2-hydroxyethylsulfanyl)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxyhexanamide Traditional Name: N-[(E)-but-2-enyl]-6-(2-hydroxyethylthio)-4-[[4-(piperidinomethyl)-2-pyridyl]oxy]hexanamide Formula: C23H37N3O3S MolecularWeight: 435.62318

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCNC(=O)CCC(CCSCCO)OC1=NC=CC(=C1)CN2CCCCC2

Isomeric SMILES

C/C=C/CNC(=O)CCC(CCSCCO)OC1=NC=CC(=C1)CN2CCCCC2

InChI

InChI=1S/C23H37N3O3S/c1-2-3-11-24-22(28)8-7-21(10-16-30-17-15-27)29-23-18-20(9-12-25-23)19-26-13-5-4-6-14-26/h2-3,9,12,18,21,27H,4-8,10-11,13-17,19H2,1H3,(H,24,28)/b3-2+