5-octylsulfanyl-N-(phenylmethyl)pentanamide

Systemtic Name: 5-octylsulfanyl-N-(phenylmethyl)pentanamide Openeye Name: N-benzyl-5-octylsulfanyl-pentanamide CAS Name: 5-(octylthio)-N-(phenylmethyl)pentanamide IUPAC Name: N-benzyl-5-octylsulfanylpentanamide Traditional Name: N-benzyl-5-(octylthio)valeramide Formula: C20H33NOS MolecularWeight: 335.54712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCCCCC(=O)NCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCSCCCCC(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C20H33NOS/c1-2-3-4-5-6-11-16-23-17-12-10-15-20(22)21-18-19-13-8-7-9-14-19/h7-9,13-14H,2-6,10-12,15-18H2,1H3,(H,21,22)