2-(phenylmethylsulfanyl)-N-prop-2-enyl-propanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-prop-2-enyl-propanamide Openeye Name: N-allyl-2-benzylsulfanyl-propanamide CAS Name: 2-(phenylmethylthio)-N-prop-2-enylpropanamide IUPAC Name: 2-benzylsulfanyl-N-prop-2-enylpropanamide Traditional Name: N-allyl-2-(benzylthio)propionamide Formula: C13H17NOS MolecularWeight: 235.34518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SCC1=CC=CC=C1

Isomeric SMILES

CC(C(=O)NCC=C)SCC1=CC=CC=C1

InChI

InChI=1S/C13H17NOS/c1-3-9-14-13(15)11(2)16-10-12-7-5-4-6-8-12/h3-8,11H,1,9-10H2,2H3,(H,14,15)