3-[2-azanyl-4-(trifluoromethyl)phenyl]sulfanyl-N-(methylcarbamoyl)propanamide

Systemtic Name: 3-[2-azanyl-4-(trifluoromethyl)phenyl]sulfanyl-N-(methylcarbamoyl)propanamide Openeye Name: 3-[2-amino-4-(trifluoromethyl)phenyl]sulfanyl-N-(methylcarbamoyl)propanamide CAS Name: 3-[[2-amino-4-(trifluoromethyl)phenyl]thio]-N-(methylcarbamoyl)propanamide IUPAC Name: 3-[2-amino-4-(trifluoromethyl)phenyl]sulfanyl-N-(methylcarbamoyl)propanamide Traditional Name: 3-[[2-amino-4-(trifluoromethyl)phenyl]thio]-N-(methylcarbamoyl)propionamide Formula: C12H14F3N3O2S MolecularWeight: 321.31867

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14F3N3O2S/c1-17-11(20)18-10(19)4-5-21-9-3-2-7(6-8(9)16)12(13,14)15/h2-3,6H,4-5,16H2,1H3,(H2,17,18,19,20)