N-(4-bromanyl-2-methyl-phenyl)-2-propylsulfonyl-benzamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-propylsulfonyl-benzamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-propylsulfonyl-benzamide CAS Name: N-(4-bromo-2-methylphenyl)-2-propylsulfonylbenzamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-propylsulfonylbenzamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-propylsulfonyl-benzamide Formula: C17H18BrNO3S MolecularWeight: 396.29872

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC=C1C(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC=C1C(=O)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C17H18BrNO3S/c1-3-10-23(21,22)16-7-5-4-6-14(16)17(20)19-15-9-8-13(18)11-12(15)2/h4-9,11H,3,10H2,1-2H3,(H,19,20)