N-(4-bromanyl-3-methyl-phenyl)-4-[[methylsulfonyl(phenyl)amino]methyl]benzamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-[[methylsulfonyl(phenyl)amino]methyl]benzamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-[(N-methylsulfonylanilino)methyl]benzamide CAS Name: N-(4-bromo-3-methylphenyl)-4-[(N-methylsulfonylanilino)methyl]benzamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-[(N-methylsulfonylanilino)methyl]benzamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-[(N-mesylanilino)methyl]benzamide Formula: C22H21BrN2O3S MolecularWeight: 473.38274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)CN(C3=CC=CC=C3)S(=O)(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)CN(C3=CC=CC=C3)S(=O)(=O)C)Br

InChI

InChI=1S/C22H21BrN2O3S/c1-16-14-19(12-13-21(16)23)24-22(26)18-10-8-17(9-11-18)15-25(29(2,27)28)20-6-4-3-5-7-20/h3-14H,15H2,1-2H3,(H,24,26)