N-(4-butylphenyl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(4-butylphenyl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: 3-benzylsulfanyl-N-(4-butylphenyl)propanamide CAS Name: N-(4-butylphenyl)-3-(phenylmethylthio)propanamide IUPAC Name: 3-benzylsulfanyl-N-(4-butylphenyl)propanamide Traditional Name: 3-(benzylthio)-N-(4-butylphenyl)propionamide Formula: C20H25NOS MolecularWeight: 327.4836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CCSCC2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CCSCC2=CC=CC=C2

InChI

InChI=1S/C20H25NOS/c1-2-3-7-17-10-12-19(13-11-17)21-20(22)14-15-23-16-18-8-5-4-6-9-18/h4-6,8-13H,2-3,7,14-16H2,1H3,(H,21,22)