N6-[2-azanyl-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2-methyl-quinoline-4,6-diamine

Systemtic Name: N6-[2-azanyl-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2-methyl-quinoline-4,6-diamine Openeye Name: N6-[2-amino-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2-methyl-quinoline-4,6-diamine CAS Name: N6-[2-amino-6-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl]-2-methylquinoline-4,6-diamine IUPAC Name: 6-N-[2-amino-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2-methylquinoline-4,6-diamine Traditional Name: (4-amino-2-methyl-6-quinolyl)-[2-amino-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]amine Formula: C21H17F3N6 MolecularWeight: 410.39509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)C4=CC=C(C=C4)C(F)(F)F)N)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)C4=CC=C(C=C4)C(F)(F)F)N)C(=C1)N

InChI

InChI=1S/C21H17F3N6/c1-11-8-16(25)15-9-14(6-7-17(15)27-11)28-19-10-18(29-20(26)30-19)12-2-4-13(5-3-12)21(22,23)24/h2-10H,1H3,(H2,25,27)(H3,26,28,29,30)