2-acetamido-N-(4-bromanyl-3-methyl-phenyl)-4-methylsulfonyl-butanamide

Systemtic Name: 2-acetamido-N-(4-bromanyl-3-methyl-phenyl)-4-methylsulfonyl-butanamide Openeye Name: 2-acetamido-N-(4-bromo-3-methyl-phenyl)-4-methylsulfonyl-butanamide CAS Name: 2-acetamido-N-(4-bromo-3-methylphenyl)-4-methylsulfonylbutanamide IUPAC Name: 2-acetamido-N-(4-bromo-3-methylphenyl)-4-methylsulfonylbutanamide Traditional Name: 2-acetamido-N-(4-bromo-3-methyl-phenyl)-4-mesyl-butyramide Formula: C14H19BrN2O4S MolecularWeight: 391.28066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(CCS(=O)(=O)C)NC(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C(CCS(=O)(=O)C)NC(=O)C)Br

InChI

InChI=1S/C14H19BrN2O4S/c1-9-8-11(4-5-12(9)15)17-14(19)13(16-10(2)18)6-7-22(3,20)21/h4-5,8,13H,6-7H2,1-3H3,(H,16,18)(H,17,19)