3-[(2-bromophenyl)methylsulfanyl]-N-(methylcarbamoyl)propanamide

Systemtic Name: 3-[(2-bromophenyl)methylsulfanyl]-N-(methylcarbamoyl)propanamide Openeye Name: 3-[(2-bromophenyl)methylsulfanyl]-N-(methylcarbamoyl)propanamide CAS Name: 3-[(2-bromophenyl)methylthio]-N-(methylcarbamoyl)propanamide IUPAC Name: 3-[(2-bromophenyl)methylsulfanyl]-N-(methylcarbamoyl)propanamide Traditional Name: 3-[(2-bromobenzyl)thio]-N-(methylcarbamoyl)propionamide Formula: C12H15BrN2O2S MolecularWeight: 331.2287

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)CCSCC1=CC=CC=C1Br

Isomeric SMILES

CNC(=O)NC(=O)CCSCC1=CC=CC=C1Br

InChI

InChI=1S/C12H15BrN2O2S/c1-14-12(17)15-11(16)6-7-18-8-9-4-2-3-5-10(9)13/h2-5H,6-8H2,1H3,(H2,14,15,16,17)