4-azido-5-(4-fluorophenyl)-6-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyrimidine

Systemtic Name: 4-azido-5-(4-fluorophenyl)-6-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyrimidine Openeye Name: 4-azido-5-(4-fluorophenyl)-6-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyrimidine CAS Name: 4-azido-5-(4-fluorophenyl)-6-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyrimidine IUPAC Name: 4-azido-5-(4-fluorophenyl)-6-(4-methylsulfonylphenyl)-2-(trifluoromethyl)pyrimidine Traditional Name: 4-azido-5-(4-fluorophenyl)-6-(4-mesylphenyl)-2-(trifluoromethyl)pyrimidine Formula: C18H11F4N5O2S MolecularWeight: 437.370853

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NC(=N2)C(F)(F)F)N=[N+]=[N-])C3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NC(=N2)C(F)(F)F)N=[N+]=[N-])C3=CC=C(C=C3)F

InChI

InChI=1S/C18H11F4N5O2S/c1-30(28,29)13-8-4-11(5-9-13)15-14(10-2-6-12(19)7-3-10)16(26-27-23)25-17(24-15)18(20,21)22/h2-9H,1H3