N3-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]-2-methyl-benzene-1,3-diamine; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N3-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]-2-methyl-benzene-1,3-diamine; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N3-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]-2-methyl-benzene-1,3-diamine; 2,2,2-trifluoroacetic acid CAS Name: N3-[4-(1H-indol-5-yloxy)-2-pyrimidinyl]-2-methylbenzene-1,3-diamine; 2,2,2-trifluoroacetic acid IUPAC Name: 3-N-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]-2-methylbenzene-1,3-diamine; 2,2,2-trifluoroacetic acid Traditional Name: (3-amino-2-methyl-phenyl)-[4-(1H-indol-5-yloxy)pyrimidin-2-yl]amine; 2,2,2-trifluoroacetic acid Formula: C21H18F3N5O3 MolecularWeight: 445.39453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC2=NC=CC(=N2)OC3=CC4=C(C=C3)NC=C4)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=C(C=CC=C1NC2=NC=CC(=N2)OC3=CC4=C(C=C3)NC=C4)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C19H17N5O.C2HF3O2/c1-12-15(20)3-2-4-16(12)23-19-22-10-8-18(24-19)25-14-5-6-17-13(11-14)7-9-21-17;3-2(4,5)1(6)7/h2-11,21H,20H2,1H3,(H,22,23,24);(H,6,7)