1-methyl-5-[(phenylmethyl)amino]-3-(trifluoromethyl)pyrazole-4-carbonitrile

Systemtic Name: 1-methyl-5-[(phenylmethyl)amino]-3-(trifluoromethyl)pyrazole-4-carbonitrile Openeye Name: 5-(benzylamino)-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonitrile CAS Name: 1-methyl-5-[(phenylmethyl)amino]-3-(trifluoromethyl)-4-pyrazolecarbonitrile IUPAC Name: 5-(benzylamino)-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonitrile Traditional Name: 5-(benzylamino)-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonitrile Formula: C13H11F3N4 MolecularWeight: 280.24845

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)C#N)NCC2=CC=CC=C2

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)C#N)NCC2=CC=CC=C2

InChI

InChI=1S/C13H11F3N4/c1-20-12(18-8-9-5-3-2-4-6-9)10(7-17)11(19-20)13(14,15)16/h2-6,18H,8H2,1H3