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

Systemtic Name: 3-cyclopropyl-4-prop-2-enyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Openeye Name: 4-allyl-3-cyclopropyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole CAS Name: 3-cyclopropyl-4-prop-2-enyl-5-[[3-(trifluoromethyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 3-cyclopropyl-4-prop-2-enyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Traditional Name: 4-allyl-3-cyclopropyl-5-[[3-(trifluoromethyl)benzyl]thio]-1,2,4-triazole Formula: C16H16F3N3S MolecularWeight: 339.37855

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC(=CC=C2)C(F)(F)F)C3CC3

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC(=CC=C2)C(F)(F)F)C3CC3

InChI

InChI=1S/C16H16F3N3S/c1-2-8-22-14(12-6-7-12)20-21-15(22)23-10-11-4-3-5-13(9-11)16(17,18)19/h2-5,9,12H,1,6-8,10H2