N4-(3-methoxyphenyl)-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine

Systemtic Name: N4-(3-methoxyphenyl)-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine Openeye Name: N4-(3-methoxyphenyl)-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine CAS Name: N4-(3-methoxyphenyl)-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(3-methoxyphenyl)-6-N-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(m-anisidino)pyrimidin-4-yl]-[3-(trifluoromethyl)phenyl]amine Formula: C18H16F3N5O MolecularWeight: 375.34775

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H16F3N5O/c1-27-14-7-3-6-13(9-14)26-17-15(22)16(23-10-24-17)25-12-5-2-4-11(8-12)18(19,20)21/h2-10H,22H2,1H3,(H2,23,24,25,26)