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

Systemtic Name: N-[(E)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]-4-pyridin-2-ylsulfanyl-butanamide Openeye Name: N-[(E)-4-[[4-(1-piperidylmethyl)-2-pyridyl]oxy]but-2-enyl]-4-(2-pyridylsulfanyl)butanamide CAS Name: N-[(E)-4-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]but-2-enyl]-4-(2-pyridinylthio)butanamide IUPAC Name: N-[(E)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]-4-pyridin-2-ylsulfanylbutanamide Traditional Name: N-[(E)-4-[[4-(piperidinomethyl)-2-pyridyl]oxy]but-2-enyl]-4-(2-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=CC=N3

Isomeric SMILES

C1CCN(CC1)CC2=CC(=NC=C2)OC/C=C/CNC(=O)CCCSC3=CC=CC=N3

InChI

InChI=1S/C24H32N4O2S/c29-22(9-8-18-31-24-10-2-3-13-27-24)25-12-4-7-17-30-23-19-21(11-14-26-23)20-28-15-5-1-6-16-28/h2-4,7,10-11,13-14,19H,1,5-6,8-9,12,15-18,20H2,(H,25,29)/b7-4+