2-[2-oxidanylidene-2-[3-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypropylamino]ethyl]sulfanylethyl ethanoate

Systemtic Name: 2-[2-oxidanylidene-2-[3-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypropylamino]ethyl]sulfanylethyl ethanoate Openeye Name: 2-[2-oxo-2-[3-[[4-(1-piperidylmethyl)-2-pyridyl]oxy]propylamino]ethyl]sulfanylethyl acetate CAS Name: acetic acid 2-[[2-oxo-2-[3-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]propylamino]ethyl]thio]ethyl ester IUPAC Name: 2-[2-oxo-2-[3-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypropylamino]ethyl]sulfanylethyl acetate Traditional Name: acetic acid 2-[[2-keto-2-[3-[[4-(piperidinomethyl)-2-pyridyl]oxy]propylamino]ethyl]thio]ethyl ester Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCSCC(=O)NCCCOC1=NC=CC(=C1)CN2CCCCC2

Isomeric SMILES

CC(=O)OCCSCC(=O)NCCCOC1=NC=CC(=C1)CN2CCCCC2

InChI

InChI=1S/C20H31N3O4S/c1-17(24)26-12-13-28-16-19(25)21-7-5-11-27-20-14-18(6-8-22-20)15-23-9-3-2-4-10-23/h6,8,14H,2-5,7,9-13,15-16H2,1H3,(H,21,25)