2-hexyl-N-(phenylmethylsulfanyl)cyclopentene-1-carboxamide

Systemtic Name: 2-hexyl-N-(phenylmethylsulfanyl)cyclopentene-1-carboxamide Openeye Name: N-benzylsulfanyl-2-hexyl-cyclopentene-1-carboxamide CAS Name: 2-hexyl-N-(phenylmethylthio)-1-cyclopentenecarboxamide IUPAC Name: N-benzylsulfanyl-2-hexylcyclopentene-1-carboxamide Traditional Name: N-(benzylthio)-2-hexyl-cyclopentene-1-carboxamide Formula: C19H27NOS MolecularWeight: 317.48878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(CCC1)C(=O)NSCC2=CC=CC=C2

Isomeric SMILES

CCCCCCC1=C(CCC1)C(=O)NSCC2=CC=CC=C2

InChI

InChI=1S/C19H27NOS/c1-2-3-4-8-12-17-13-9-14-18(17)19(21)20-22-15-16-10-6-5-7-11-16/h5-7,10-11H,2-4,8-9,12-15H2,1H3,(H,20,21)