5-bromanyl-N-[(4-methylsulfonylphenyl)methyl]thiophene-3-carboxamide

Systemtic Name: 5-bromanyl-N-[(4-methylsulfonylphenyl)methyl]thiophene-3-carboxamide Openeye Name: 5-bromo-N-[(4-methylsulfonylphenyl)methyl]thiophene-3-carboxamide CAS Name: 5-bromo-N-[(4-methylsulfonylphenyl)methyl]-3-thiophenecarboxamide IUPAC Name: 5-bromo-N-[(4-methylsulfonylphenyl)methyl]thiophene-3-carboxamide Traditional Name: 5-bromo-N-(4-mesylbenzyl)thiophene-3-carboxamide Formula: C13H12BrNO3S2 MolecularWeight: 374.27328

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CSC(=C2)Br

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CSC(=C2)Br

InChI

InChI=1S/C13H12BrNO3S2/c1-20(17,18)11-4-2-9(3-5-11)7-15-13(16)10-6-12(14)19-8-10/h2-6,8H,7H2,1H3,(H,15,16)