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

Systemtic Name: 4-[5-(4-fluorophenyl)-3-(phenylsulfonyl)-1,2,3-triazol-4-yl]-N-phenethyl-pyrimidin-2-amine Openeye Name: 4-[3-(benzenesulfonyl)-5-(4-fluorophenyl)triazol-4-yl]-N-phenethyl-pyrimidin-2-amine CAS Name: 4-[3-(benzenesulfonyl)-5-(4-fluorophenyl)-4-triazolyl]-N-phenethyl-2-pyrimidinamine IUPAC Name: 4-[3-(benzenesulfonyl)-5-(4-fluorophenyl)triazol-4-yl]-N-phenethylpyrimidin-2-amine Traditional Name: [4-[3-besyl-5-(4-fluorophenyl)triazol-4-yl]pyrimidin-2-yl]-phenethyl-amine Formula: C26H21FN6O2S MolecularWeight: 500.547343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC=CC(=N2)C3=C(N=NN3S(=O)(=O)C4=CC=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC=CC(=N2)C3=C(N=NN3S(=O)(=O)C4=CC=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H21FN6O2S/c27-21-13-11-20(12-14-21)24-25(33(32-31-24)36(34,35)22-9-5-2-6-10-22)23-16-18-29-26(30-23)28-17-15-19-7-3-1-4-8-19/h1-14,16,18H,15,17H2,(H,28,29,30)