2-[(3-bromophenyl)-methylsulfonyl-amino]-N-(3-methyl-1-phenyl-butyl)ethanamide

Systemtic Name: 2-[(3-bromophenyl)-methylsulfonyl-amino]-N-(3-methyl-1-phenyl-butyl)ethanamide Openeye Name: 2-(3-bromo-N-methylsulfonyl-anilino)-N-(3-methyl-1-phenyl-butyl)acetamide CAS Name: 2-(3-bromo-N-methylsulfonylanilino)-N-(3-methyl-1-phenylbutyl)acetamide IUPAC Name: 2-(3-bromo-N-methylsulfonylanilino)-N-(3-methyl-1-phenylbutyl)acetamide Traditional Name: 2-(3-bromo-N-mesyl-anilino)-N-(3-methyl-1-phenyl-butyl)acetamide Formula: C20H25BrN2O3S MolecularWeight: 453.3931

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25BrN2O3S/c1-15(2)12-19(16-8-5-4-6-9-16)22-20(24)14-23(27(3,25)26)18-11-7-10-17(21)13-18/h4-11,13,15,19H,12,14H2,1-3H3,(H,22,24)