(2S)-2-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoylamino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoylamino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[2-(4-bromo-2-methyl-phenyl)sulfanylacetyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[2-[(4-bromo-2-methylphenyl)thio]-1-oxoethyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[2-(4-bromo-2-methylphenyl)sulfanylacetyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[2-[(4-bromo-2-methyl-phenyl)thio]acetyl]amino]-N-ethyl-propionamide Formula: C14H19BrN2O2S MolecularWeight: 359.28186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrN2O2S/c1-4-16-14(19)10(3)17-13(18)8-20-12-6-5-11(15)7-9(12)2/h5-7,10H,4,8H2,1-3H3,(H,16,19)(H,17,18)/t10-/m0/s1