N-methyl-N-(quinolin-5-ylmethyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazin-3-amine

Systemtic Name: N-methyl-N-(quinolin-5-ylmethyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazin-3-amine Openeye Name: N-methyl-N-(5-quinolylmethyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazin-3-amine CAS Name: N-methyl-N-(5-quinolinylmethyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazin-3-amine IUPAC Name: N-methyl-N-(quinolin-5-ylmethyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazin-3-amine Traditional Name: methyl-(5-quinolylmethyl)-[5-[4-(trifluoromethyl)phenyl]-1,2,4-triazin-3-yl]amine Formula: C21H16F3N5 MolecularWeight: 395.38045

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C2C=CC=NC2=CC=C1)C3=NC(=CN=N3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CN(CC1=C2C=CC=NC2=CC=C1)C3=NC(=CN=N3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H16F3N5/c1-29(13-15-4-2-6-18-17(15)5-3-11-25-18)20-27-19(12-26-28-20)14-7-9-16(10-8-14)21(22,23)24/h2-12H,13H2,1H3