2-bromanyl-N-ethyl-2-[3-[methylsulfonyl-(phenylmethyl)amino]-2,4-bis(oxidanyl)phenyl]ethanamide

Systemtic Name: 2-bromanyl-N-ethyl-2-[3-[methylsulfonyl-(phenylmethyl)amino]-2,4-bis(oxidanyl)phenyl]ethanamide Openeye Name: 2-[3-[benzyl(methylsulfonyl)amino]-2,4-dihydroxy-phenyl]-2-bromo-N-ethyl-acetamide CAS Name: 2-bromo-2-[2,4-dihydroxy-3-[methylsulfonyl-(phenylmethyl)amino]phenyl]-N-ethylacetamide IUPAC Name: 2-[3-[benzyl(methylsulfonyl)amino]-2,4-dihydroxyphenyl]-2-bromo-N-ethylacetamide Traditional Name: 2-[3-[benzyl(mesyl)amino]-2,4-dihydroxy-phenyl]-2-bromo-N-ethyl-acetamide Formula: C18H21BrN2O5S MolecularWeight: 457.33874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21BrN2O5S/c1-3-20-18(24)15(19)13-9-10-14(22)16(17(13)23)21(27(2,25)26)11-12-7-5-4-6-8-12/h4-10,15,22-23H,3,11H2,1-2H3,(H,20,24)