2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[2-(trifluoromethyl)phenyl]butanamide

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[2-(trifluoromethyl)phenyl]butanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[2-(trifluoromethyl)phenyl]butanamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-[2-(trifluoromethyl)phenyl]butanamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[2-(trifluoromethyl)phenyl]butanamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-[2-(trifluoromethyl)phenyl]butyramide Formula: C14H16F3N5OS MolecularWeight: 359.36995

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(F)(F)F)N2C(=NN=C2SC)N

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(F)(F)F)N2C(=NN=C2SC)N

InChI

InChI=1S/C14H16F3N5OS/c1-3-10(22-12(18)20-21-13(22)24-2)11(23)19-9-7-5-4-6-8(9)14(15,16)17/h4-7,10H,3H2,1-2H3,(H2,18,20)(H,19,23)