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

Systemtic Name: N-pentan-2-yl-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(1-methylbutyl)acetamide CAS Name: N-pentan-2-yl-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-pentan-2-ylacetamide Traditional Name: 2-(benzylthio)-N-(1-methylbutyl)acetamide Formula: C14H21NOS MolecularWeight: 251.38764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NOS/c1-3-7-12(2)15-14(16)11-17-10-13-8-5-4-6-9-13/h4-6,8-9,12H,3,7,10-11H2,1-2H3,(H,15,16)