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

Systemtic Name: 2-[2-azanyl-4-(trifluoromethyl)phenyl]sulfanyl-N-propyl-propanamide Openeye Name: 2-[2-amino-4-(trifluoromethyl)phenyl]sulfanyl-N-propyl-propanamide CAS Name: 2-[[2-amino-4-(trifluoromethyl)phenyl]thio]-N-propylpropanamide IUPAC Name: 2-[2-amino-4-(trifluoromethyl)phenyl]sulfanyl-N-propylpropanamide Traditional Name: 2-[[2-amino-4-(trifluoromethyl)phenyl]thio]-N-propyl-propionamide Formula: C13H17F3N2OS MolecularWeight: 306.34709

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=C(C=C(C=C1)C(F)(F)F)N

Isomeric SMILES

CCCNC(=O)C(C)SC1=C(C=C(C=C1)C(F)(F)F)N

InChI

InChI=1S/C13H17F3N2OS/c1-3-6-18-12(19)8(2)20-11-5-4-9(7-10(11)17)13(14,15)16/h4-5,7-8H,3,6,17H2,1-2H3,(H,18,19)