N-(4-cyanophenyl)-3-propylsulfanyl-propanamide

Systemtic Name: N-(4-cyanophenyl)-3-propylsulfanyl-propanamide Openeye Name: N-(4-cyanophenyl)-3-propylsulfanyl-propanamide CAS Name: N-(4-cyanophenyl)-3-(propylthio)propanamide IUPAC Name: N-(4-cyanophenyl)-3-propylsulfanylpropanamide Traditional Name: N-(4-cyanophenyl)-3-(propylthio)propionamide Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCC(=O)NC1=CC=C(C=C1)C#N

Isomeric SMILES

CCCSCCC(=O)NC1=CC=C(C=C1)C#N

InChI

InChI=1S/C13H16N2OS/c1-2-8-17-9-7-13(16)15-12-5-3-11(10-14)4-6-12/h3-6H,2,7-9H2,1H3,(H,15,16)