2-(2-azanylethylsulfanyl)-2-[3-(piperidin-1-ylmethyl)phenoxy]pentanamide

Systemtic Name: 2-(2-azanylethylsulfanyl)-2-[3-(piperidin-1-ylmethyl)phenoxy]pentanamide Openeye Name: 2-(2-aminoethylsulfanyl)-2-[3-(1-piperidylmethyl)phenoxy]pentanamide CAS Name: 2-(2-aminoethylthio)-2-[3-(1-piperidinylmethyl)phenoxy]pentanamide IUPAC Name: 2-(2-aminoethylsulfanyl)-2-[3-(piperidin-1-ylmethyl)phenoxy]pentanamide Traditional Name: 2-(2-aminoethylthio)-2-[3-(piperidinomethyl)phenoxy]valeramide Formula: C19H31N3O2S MolecularWeight: 365.53334

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N)(OC1=CC=CC(=C1)CN2CCCCC2)SCCN

Isomeric SMILES

CCCC(C(=O)N)(OC1=CC=CC(=C1)CN2CCCCC2)SCCN

InChI

InChI=1S/C19H31N3O2S/c1-2-9-19(18(21)23,25-13-10-20)24-17-8-6-7-16(14-17)15-22-11-4-3-5-12-22/h6-8,14H,2-5,9-13,15,20H2,1H3,(H2,21,23)