2-[2-oxidanylidene-2-[5-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypentylamino]ethyl]sulfanylethyl ethanoate

Systemtic Name: 2-[2-oxidanylidene-2-[5-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypentylamino]ethyl]sulfanylethyl ethanoate Openeye Name: 2-[2-oxo-2-[5-[[4-(1-piperidylmethyl)-2-pyridyl]oxy]pentylamino]ethyl]sulfanylethyl acetate CAS Name: acetic acid 2-[[2-oxo-2-[5-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]pentylamino]ethyl]thio]ethyl ester IUPAC Name: 2-[2-oxo-2-[5-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypentylamino]ethyl]sulfanylethyl acetate Traditional Name: acetic acid 2-[[2-keto-2-[5-[[4-(piperidinomethyl)-2-pyridyl]oxy]pentylamino]ethyl]thio]ethyl ester Formula: C22H35N3O4S MolecularWeight: 437.596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCSCC(=O)NCCCCCOC1=NC=CC(=C1)CN2CCCCC2

Isomeric SMILES

CC(=O)OCCSCC(=O)NCCCCCOC1=NC=CC(=C1)CN2CCCCC2

InChI

InChI=1S/C22H35N3O4S/c1-19(26)28-14-15-30-18-21(27)23-9-4-2-7-13-29-22-16-20(8-10-24-22)17-25-11-5-3-6-12-25/h8,10,16H,2-7,9,11-15,17-18H2,1H3,(H,23,27)