N-(3-bromophenyl)-6-(2-sulfanylethanoylamino)hexanamide

Systemtic Name: N-(3-bromophenyl)-6-(2-sulfanylethanoylamino)hexanamide Openeye Name: N-(3-bromophenyl)-6-[(2-sulfanylacetyl)amino]hexanamide CAS Name: N-(3-bromophenyl)-6-[(2-mercapto-1-oxoethyl)amino]hexanamide IUPAC Name: N-(3-bromophenyl)-6-[(2-sulfanylacetyl)amino]hexanamide Traditional Name: N-(3-bromophenyl)-6-[(2-mercaptoacetyl)amino]hexanamide Formula: C14H19BrN2O2S MolecularWeight: 359.28186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC(=O)CCCCCNC(=O)CS

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC(=O)CCCCCNC(=O)CS

InChI

InChI=1S/C14H19BrN2O2S/c15-11-5-4-6-12(9-11)17-13(18)7-2-1-3-8-16-14(19)10-20/h4-6,9,20H,1-3,7-8,10H2,(H,16,19)(H,17,18)