2-[(3-bromophenyl)-(phenylsulfonyl)amino]-N-phenethyl-ethanamide

Systemtic Name: 2-[(3-bromophenyl)-(phenylsulfonyl)amino]-N-phenethyl-ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-bromo-anilino]-N-phenethyl-acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-bromoanilino]-N-phenethylacetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-bromoanilino]-N-phenethylacetamide Traditional Name: 2-(N-besyl-3-bromo-anilino)-N-phenethyl-acetamide Formula: C22H21BrN2O3S MolecularWeight: 473.38274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CN(C2=CC(=CC=C2)Br)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CN(C2=CC(=CC=C2)Br)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21BrN2O3S/c23-19-10-7-11-20(16-19)25(29(27,28)21-12-5-2-6-13-21)17-22(26)24-15-14-18-8-3-1-4-9-18/h1-13,16H,14-15,17H2,(H,24,26)