N-octan-2-yl-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-octan-2-yl-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(1-methylheptyl)acetamide CAS Name: N-octan-2-yl-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-octan-2-ylacetamide Traditional Name: 2-(benzylthio)-N-(1-methylheptyl)acetamide Formula: C17H27NOS MolecularWeight: 293.46738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)CSCC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(C)NC(=O)CSCC1=CC=CC=C1

InChI

InChI=1S/C17H27NOS/c1-3-4-5-7-10-15(2)18-17(19)14-20-13-16-11-8-6-9-12-16/h6,8-9,11-12,15H,3-5,7,10,13-14H2,1-2H3,(H,18,19)