4-[3-(ethoxymethyl)-5-(4-fluorophenyl)-1,2,3-triazol-4-yl]-6-phenoxy-pyrimidine

Systemtic Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)-1,2,3-triazol-4-yl]-6-phenoxy-pyrimidine Openeye Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)triazol-4-yl]-6-phenoxy-pyrimidine CAS Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)-4-triazolyl]-6-phenoxypyrimidine IUPAC Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)triazol-4-yl]-6-phenoxypyrimidine Traditional Name: 4-[3-(ethoxymethyl)-5-(4-fluorophenyl)triazol-4-yl]-6-phenoxy-pyrimidine Formula: C21H18FN5O2 MolecularWeight: 391.398323

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Descriptors Computed from Structure

Canonical SMILES:

CCOCN1C(=C(N=N1)C2=CC=C(C=C2)F)C3=CC(=NC=N3)OC4=CC=CC=C4

Isomeric SMILES

CCOCN1C(=C(N=N1)C2=CC=C(C=C2)F)C3=CC(=NC=N3)OC4=CC=CC=C4

InChI

InChI=1S/C21H18FN5O2/c1-2-28-14-27-21(20(25-26-27)15-8-10-16(22)11-9-15)18-12-19(24-13-23-18)29-17-6-4-3-5-7-17/h3-13H,2,14H2,1H3