ethyl 2-[2-oxidanylidene-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-oxidanylidene-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-oxo-2-[3-[3-(1-piperidylmethyl)phenoxy]propylamino]ethyl]sulfanylacetate CAS Name: 2-[[2-oxo-2-[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]ethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-oxo-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]ethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[3-[3-(piperidinomethyl)phenoxy]propylamino]ethyl]thio]acetic acid ethyl ester Formula: C21H32N2O4S MolecularWeight: 408.55478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NCCCOC1=CC=CC(=C1)CN2CCCCC2

Isomeric SMILES

CCOC(=O)CSCC(=O)NCCCOC1=CC=CC(=C1)CN2CCCCC2

InChI

InChI=1S/C21H32N2O4S/c1-2-26-21(25)17-28-16-20(24)22-10-7-13-27-19-9-6-8-18(14-19)15-23-11-4-3-5-12-23/h6,8-9,14H,2-5,7,10-13,15-17H2,1H3,(H,22,24)