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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(4-bromophenyl)methyl-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[benzenesulfonyl-[(4-bromophenyl)methyl]amino]-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: 2-[benzenesulfonyl-[(4-bromophenyl)methyl]amino]-N-(1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-[benzenesulfonyl-[(4-bromophenyl)methyl]amino]-N-(1,3-benzodioxol-5-yl)acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[besyl-(4-bromobenzyl)amino]acetamide Formula: C22H19BrN2O5S MolecularWeight: 503.36566

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CN(CC3=CC=C(C=C3)Br)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CN(CC3=CC=C(C=C3)Br)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H19BrN2O5S/c23-17-8-6-16(7-9-17)13-25(31(27,28)19-4-2-1-3-5-19)14-22(26)24-18-10-11-20-21(12-18)30-15-29-20/h1-12H,13-15H2,(H,24,26)