2-(1-azanyl-3-methylsulfanyl-propyl)-N-[[2-(trifluoromethyl)phenyl]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-[[2-(trifluoromethyl)phenyl]methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-[[2-(trifluoromethyl)phenyl]methyl]oxazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[[2-(trifluoromethyl)phenyl]methyl]-4-oxazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-[[2-(trifluoromethyl)phenyl]methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-[2-(trifluoromethyl)benzyl]oxazole-4-carboxamide Formula: C16H18F3N3O2S MolecularWeight: 373.39323

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC(=CO1)C(=O)NCC2=CC=CC=C2C(F)(F)F)N

Isomeric SMILES

CSCCC(C1=NC(=CO1)C(=O)NCC2=CC=CC=C2C(F)(F)F)N

InChI

InChI=1S/C16H18F3N3O2S/c1-25-7-6-12(20)15-22-13(9-24-15)14(23)21-8-10-4-2-3-5-11(10)16(17,18)19/h2-5,9,12H,6-8,20H2,1H3,(H,21,23)