(2S)-2-[2-(4-bromophenyl)sulfanylethanoylamino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[2-(4-bromophenyl)sulfanylethanoylamino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[2-(4-bromophenyl)sulfanylacetyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[2-[(4-bromophenyl)thio]-1-oxoethyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[2-(4-bromophenyl)sulfanylacetyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[2-[(4-bromophenyl)thio]acetyl]amino]-N-ethyl-propionamide Formula: C13H17BrN2O2S MolecularWeight: 345.25528

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CSC1=CC=C(C=C1)Br

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CSC1=CC=C(C=C1)Br

InChI

InChI=1S/C13H17BrN2O2S/c1-3-15-13(18)9(2)16-12(17)8-19-11-6-4-10(14)5-7-11/h4-7,9H,3,8H2,1-2H3,(H,15,18)(H,16,17)/t9-/m0/s1