N-[(1R)-1-(2-bromophenyl)ethyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(2-bromophenyl)ethyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1R)-1-(2-bromophenyl)ethyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[(1R)-1-(2-bromophenyl)ethyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[(1R)-1-(2-bromophenyl)ethyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[(1R)-1-(2-bromophenyl)ethyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C15H15BrN2O2S MolecularWeight: 367.2608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=C1Br)NC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C15H15BrN2O2S/c1-11(12-6-2-3-7-13(12)16)17-14(19)10-21-15-8-4-5-9-18(15)20/h2-9,11H,10H2,1H3,(H,17,19)/t11-/m1/s1