2-bromanyl-N-ethyl-2-[3-[methylsulfonyl-(phenylmethyl)amino]-2-oxidanyl-phenyl]ethanamide

Systemtic Name: 2-bromanyl-N-ethyl-2-[3-[methylsulfonyl-(phenylmethyl)amino]-2-oxidanyl-phenyl]ethanamide Openeye Name: 2-[3-[benzyl(methylsulfonyl)amino]-2-hydroxy-phenyl]-2-bromo-N-ethyl-acetamide CAS Name: 2-bromo-N-ethyl-2-[2-hydroxy-3-[methylsulfonyl-(phenylmethyl)amino]phenyl]acetamide IUPAC Name: 2-[3-[benzyl(methylsulfonyl)amino]-2-hydroxyphenyl]-2-bromo-N-ethylacetamide Traditional Name: 2-[3-[benzyl(mesyl)amino]-2-hydroxy-phenyl]-2-bromo-N-ethyl-acetamide Formula: C18H21BrN2O4S MolecularWeight: 441.33934

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C1=C(C(=CC=C1)N(CC2=CC=CC=C2)S(=O)(=O)C)O)Br

Isomeric SMILES

CCNC(=O)C(C1=C(C(=CC=C1)N(CC2=CC=CC=C2)S(=O)(=O)C)O)Br

InChI

InChI=1S/C18H21BrN2O4S/c1-3-20-18(23)16(19)14-10-7-11-15(17(14)22)21(26(2,24)25)12-13-8-5-4-6-9-13/h4-11,16,22H,3,12H2,1-2H3,(H,20,23)