2-[1-azanyl-1-oxidanylidene-5-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxy-pentan-2-yl]sulfanylethyl ethanoate

Systemtic Name: 2-[1-azanyl-1-oxidanylidene-5-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxy-pentan-2-yl]sulfanylethyl ethanoate Openeye Name: 2-[1-carbamoyl-4-[[4-(1-piperidylmethyl)-2-pyridyl]oxy]butyl]sulfanylethyl acetate CAS Name: acetic acid 2-[[1-amino-1-oxo-5-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]pentan-2-yl]thio]ethyl ester IUPAC Name: 2-[1-amino-1-oxo-5-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxypentan-2-yl]sulfanylethyl acetate Traditional Name: acetic acid 2-[[1-carbamoyl-4-[[4-(piperidinomethyl)-2-pyridyl]oxy]butyl]thio]ethyl ester Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCSC(CCCOC1=NC=CC(=C1)CN2CCCCC2)C(=O)N

Isomeric SMILES

CC(=O)OCCSC(CCCOC1=NC=CC(=C1)CN2CCCCC2)C(=O)N

InChI

InChI=1S/C20H31N3O4S/c1-16(24)26-12-13-28-18(20(21)25)6-5-11-27-19-14-17(7-8-22-19)15-23-9-3-2-4-10-23/h7-8,14,18H,2-6,9-13,15H2,1H3,(H2,21,25)