4-cyclopropyl-3-thiophen-2-yl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-thiophen-2-yl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-(2-thienyl)-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole CAS Name: 4-cyclopropyl-3-thiophen-2-yl-5-[[3-(trifluoromethyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-thiophen-2-yl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-(2-thienyl)-5-[[3-(trifluoromethyl)benzyl]thio]-1,2,4-triazole Formula: C17H14F3N3S2 MolecularWeight: 381.43837

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC(=CC=C3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC(=CC=C3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C17H14F3N3S2/c18-17(19,20)12-4-1-3-11(9-12)10-25-16-22-21-15(14-5-2-8-24-14)23(16)13-6-7-13/h1-5,8-9,13H,6-7,10H2