N-(1,3-benzodioxol-5-yl)-2-[(3-bromophenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(3-bromophenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[3-bromo-N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(3-bromo-N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(3-bromo-N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(3-bromo-N-tosyl-anilino)acetamide Formula: C22H19BrN2O5S MolecularWeight: 503.36566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H19BrN2O5S/c1-15-5-8-19(9-6-15)31(27,28)25(18-4-2-3-16(23)11-18)13-22(26)24-17-7-10-20-21(12-17)30-14-29-20/h2-12H,13-14H2,1H3,(H,24,26)