N-(3-bromophenyl)-2-[(4-methylphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(3-bromophenyl)-2-[(4-methylphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(3-bromophenyl)-2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: N-(3-bromophenyl)-2-(4-methyl-N-[4-(methylthio)phenyl]sulfonylanilino)acetamide IUPAC Name: N-(3-bromophenyl)-2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide Traditional Name: N-(3-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=C2)Br)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)NC2=CC(=CC=C2)Br)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

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