N-(2-bromanyl-4-methyl-phenyl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-(2-bromo-4-methyl-phenyl)propanamide CAS Name: N-(2-bromo-4-methylphenyl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-(2-bromo-4-methylphenyl)propanamide Traditional Name: 3-benzylsulfonyl-N-(2-bromo-4-methyl-phenyl)propionamide Formula: C17H18BrNO3S MolecularWeight: 396.29872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2)Br

InChI

InChI=1S/C17H18BrNO3S/c1-13-7-8-16(15(18)11-13)19-17(20)9-10-23(21,22)12-14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,19,20)