N-[(E)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]-4-pyridin-4-ylsulfanyl-butanamide

Systemtic Name: N-[(E)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]-4-pyridin-4-ylsulfanyl-butanamide Openeye Name: N-[(E)-4-[[4-(1-piperidylmethyl)-2-pyridyl]oxy]but-2-enyl]-4-(4-pyridylsulfanyl)butanamide CAS Name: N-[(E)-4-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]but-2-enyl]-4-(pyridin-4-ylthio)butanamide IUPAC Name: N-[(E)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]-4-pyridin-4-ylsulfanylbutanamide Traditional Name: N-[(E)-4-[[4-(piperidinomethyl)-2-pyridyl]oxy]but-2-enyl]-4-(4-pyridylthio)butyramide Formula: C24H32N4O2S MolecularWeight: 440.60148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=NC=C2)OCC=CCNC(=O)CCCSC3=CC=NC=C3

Isomeric SMILES

C1CCN(CC1)CC2=CC(=NC=C2)OC/C=C/CNC(=O)CCCSC3=CC=NC=C3

InChI

InChI=1S/C24H32N4O2S/c29-23(7-6-18-31-22-9-12-25-13-10-22)26-11-2-5-17-30-24-19-21(8-14-27-24)20-28-15-3-1-4-16-28/h2,5,8-10,12-14,19H,1,3-4,6-7,11,15-18,20H2,(H,26,29)/b5-2+