3-(4-azanyl-2-fluoranyl-phenyl)sulfanyl-N-(methylcarbamoyl)propanamide

Systemtic Name: 3-(4-azanyl-2-fluoranyl-phenyl)sulfanyl-N-(methylcarbamoyl)propanamide Openeye Name: 3-(4-amino-2-fluoro-phenyl)sulfanyl-N-(methylcarbamoyl)propanamide CAS Name: 3-[(4-amino-2-fluorophenyl)thio]-N-(methylcarbamoyl)propanamide IUPAC Name: 3-(4-amino-2-fluorophenyl)sulfanyl-N-(methylcarbamoyl)propanamide Traditional Name: 3-[(4-amino-2-fluoro-phenyl)thio]-N-(methylcarbamoyl)propionamide Formula: C11H14FN3O2S MolecularWeight: 271.311163

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)CCSC1=C(C=C(C=C1)N)F

Isomeric SMILES

CNC(=O)NC(=O)CCSC1=C(C=C(C=C1)N)F

InChI

InChI=1S/C11H14FN3O2S/c1-14-11(17)15-10(16)4-5-18-9-3-2-7(13)6-8(9)12/h2-3,6H,4-5,13H2,1H3,(H2,14,15,16,17)