N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(trifluoromethyl)benzamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-3-(trifluoromethyl)benzamide Formula: C19H23F3N4OS MolecularWeight: 412.47233

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H23F3N4OS/c1-28-18-25-24-16(26(18)15-8-2-3-9-15)10-5-11-23-17(27)13-6-4-7-14(12-13)19(20,21)22/h4,6-7,12,15H,2-3,5,8-11H2,1H3,(H,23,27)