3-methyl-7-[2-phenyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]azepan-2-amine

Systemtic Name: 3-methyl-7-[2-phenyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]azepan-2-amine Openeye Name: 3-methyl-7-[2-phenyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]azepan-2-amine CAS Name: 3-methyl-7-[2-phenyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]-2-azepanamine IUPAC Name: 3-methyl-7-[2-phenyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]azepan-2-amine Traditional Name: [3-methyl-7-[2-phenyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]azepan-2-yl]amine Formula: C16H20F3N5 MolecularWeight: 339.35871

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(NC1N)C2=NC(=NN2C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1CCCC(NC1N)C2=NC(=NN2C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C16H20F3N5/c1-10-6-5-9-12(21-13(10)20)14-22-15(16(17,18)19)23-24(14)11-7-3-2-4-8-11/h2-4,7-8,10,12-13,21H,5-6,9,20H2,1H3