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

Systemtic Name: S-[2-oxidanylidene-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]ethyl] ethanethioate Openeye Name: S-[2-oxo-2-[3-[3-(1-piperidylmethyl)phenoxy]propylamino]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-oxo-2-[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]ethyl] ester IUPAC Name: S-[2-oxo-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[3-[3-(piperidinomethyl)phenoxy]propylamino]ethyl] ester Formula: C19H28N2O3S MolecularWeight: 364.50222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)NCCCOC1=CC=CC(=C1)CN2CCCCC2

Isomeric SMILES

CC(=O)SCC(=O)NCCCOC1=CC=CC(=C1)CN2CCCCC2

InChI

InChI=1S/C19H28N2O3S/c1-16(22)25-15-19(23)20-9-6-12-24-18-8-5-7-17(13-18)14-21-10-3-2-4-11-21/h5,7-8,13H,2-4,6,9-12,14-15H2,1H3,(H,20,23)