N-(2-bromophenyl)-2-[(4-methylphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[(4-methylphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(2-bromophenyl)-2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: N-(2-bromophenyl)-2-(4-methyl-N-[4-(methylthio)phenyl]sulfonylanilino)acetamide IUPAC Name: N-(2-bromophenyl)-2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide Traditional Name: N-(2-bromophenyl)-2-(4-methyl-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetamide Formula: C22H21BrN2O3S2 MolecularWeight: 505.44774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2Br)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2Br)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C22H21BrN2O3S2/c1-16-7-9-17(10-8-16)25(15-22(26)24-21-6-4-3-5-20(21)23)30(27,28)19-13-11-18(29-2)12-14-19/h3-14H,15H2,1-2H3,(H,24,26)