4-[3-(ethoxymethyl)-5-(4-fluorophenyl)-1,2,3-triazol-4-yl]-N-phenyl-pyrimidin-2-amine

Systemtic Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)-1,2,3-triazol-4-yl]-N-phenyl-pyrimidin-2-amine Openeye Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)triazol-4-yl]-N-phenyl-pyrimidin-2-amine CAS Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)-4-triazolyl]-N-phenyl-2-pyrimidinamine IUPAC Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)triazol-4-yl]-N-phenylpyrimidin-2-amine Traditional Name: [4-[3-(ethoxymethyl)-5-(4-fluorophenyl)triazol-4-yl]pyrimidin-2-yl]-phenyl-amine Formula: C21H19FN6O MolecularWeight: 390.413563

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Descriptors Computed from Structure

Canonical SMILES:

CCOCN1C(=C(N=N1)C2=CC=C(C=C2)F)C3=NC(=NC=C3)NC4=CC=CC=C4

Isomeric SMILES

CCOCN1C(=C(N=N1)C2=CC=C(C=C2)F)C3=NC(=NC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C21H19FN6O/c1-2-29-14-28-20(19(26-27-28)15-8-10-16(22)11-9-15)18-12-13-23-21(25-18)24-17-6-4-3-5-7-17/h3-13H,2,14H2,1H3,(H,23,24,25)