N-(2-bromophenyl)-4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-(2-bromophenyl)-4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-(2-bromophenyl)-4-(2,5-dimethyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-(2-bromophenyl)-4-(2,5-dimethyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-(2-bromophenyl)-4-(2,5-dimethyl-N-methylsulfonylanilino)butanamide Traditional Name: N-(2-bromophenyl)-4-(N-mesyl-2,5-dimethyl-anilino)butyramide Formula: C19H23BrN2O3S MolecularWeight: 439.36652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23BrN2O3S/c1-14-10-11-15(2)18(13-14)22(26(3,24)25)12-6-9-19(23)21-17-8-5-4-7-16(17)20/h4-5,7-8,10-11,13H,6,9,12H2,1-3H3,(H,21,23)