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N-butyl-3-(phenylmethylsulfanyl)propanamide

N-butyl-3-(phenylmethylsulfanyl)propanamide

Systemtic Name:N-butyl-3-(phenylmethylsulfanyl)propanamide
Openeye Name:3-benzylsulfanyl-N-butyl-propanamide
CAS Name:N-butyl-3-(phenylmethylthio)propanamide
IUPAC Name:3-benzylsulfanyl-N-butylpropanamide
Traditional Name:3-(benzylthio)-N-butyl-propionamide
Formula: C14H21NOS
MolecularWeight: 251.38764
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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCSCC1=CC=CC=C1


Isomeric SMILES

CCCCNC(=O)CCSCC1=CC=CC=C1


InChI

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


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