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

Systemtic Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)-1,2,3-triazol-4-yl]-N-methyl-pyrimidin-2-amine Openeye Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)triazol-4-yl]-N-methyl-pyrimidin-2-amine CAS Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)-4-triazolyl]-N-methyl-2-pyrimidinamine IUPAC Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)triazol-4-yl]-N-methylpyrimidin-2-amine Traditional Name: [4-[3-(ethoxymethyl)-5-(4-fluorophenyl)triazol-4-yl]pyrimidin-2-yl]-methyl-amine Formula: C16H17FN6O MolecularWeight: 328.344183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17FN6O/c1-3-24-10-23-15(13-8-9-19-16(18-2)20-13)14(21-22-23)11-4-6-12(17)7-5-11/h4-9H,3,10H2,1-2H3,(H,18,19,20)