N-(2-methylpropyl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(2-methylpropyl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: 3-benzylsulfanyl-N-isobutyl-propanamide CAS Name: N-(2-methylpropyl)-3-(phenylmethylthio)propanamide IUPAC Name: 3-benzylsulfanyl-N-(2-methylpropyl)propanamide Traditional Name: 3-(benzylthio)-N-isobutyl-propionamide Formula: C14H21NOS MolecularWeight: 251.38764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CCSCC1=CC=CC=C1

Isomeric SMILES

CC(C)CNC(=O)CCSCC1=CC=CC=C1

InChI

InChI=1S/C14H21NOS/c1-12(2)10-15-14(16)8-9-17-11-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H,15,16)