5-(cyclohexen-1-yl)-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole

Systemtic Name: 5-(cyclohexen-1-yl)-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Openeye Name: 5-(cyclohexen-1-yl)-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole CAS Name: 5-(1-cyclohexenyl)-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole IUPAC Name: 5-(cyclohexen-1-yl)-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Traditional Name: 5-(cyclohexen-1-yl)-1-(4-mesylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Formula: C16H16F3N3O2S MolecularWeight: 371.37735

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=CCCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=CCCCC3

InChI

InChI=1S/C16H16F3N3O2S/c1-25(23,24)13-9-7-12(8-10-13)22-14(11-5-3-2-4-6-11)20-15(21-22)16(17,18)19/h5,7-10H,2-4,6H2,1H3