N-(methylcarbamoyl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(methylcarbamoyl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: 3-benzylsulfanyl-N-(methylcarbamoyl)propanamide CAS Name: N-(methylcarbamoyl)-3-(phenylmethylthio)propanamide IUPAC Name: 3-benzylsulfanyl-N-(methylcarbamoyl)propanamide Traditional Name: 3-(benzylthio)-N-(methylcarbamoyl)propionamide Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)CCSCC1=CC=CC=C1

Isomeric SMILES

CNC(=O)NC(=O)CCSCC1=CC=CC=C1

InChI

InChI=1S/C12H16N2O2S/c1-13-12(16)14-11(15)7-8-17-9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H2,13,14,15,16)