5-(4-fluorophenyl)-1-methyl-7-(2-phenylethynyl)-3-propyl-pyrazolo[4,3-d]pyrimidine

Systemtic Name: 5-(4-fluorophenyl)-1-methyl-7-(2-phenylethynyl)-3-propyl-pyrazolo[4,3-d]pyrimidine Openeye Name: 5-(4-fluorophenyl)-1-methyl-7-(2-phenylethynyl)-3-propyl-pyrazolo[4,3-d]pyrimidine CAS Name: 5-(4-fluorophenyl)-1-methyl-7-(2-phenylethynyl)-3-propylpyrazolo[4,3-d]pyrimidine IUPAC Name: 5-(4-fluorophenyl)-1-methyl-7-(2-phenylethynyl)-3-propylpyrazolo[4,3-d]pyrimidine Traditional Name: 5-(4-fluorophenyl)-1-methyl-7-(2-phenylethynyl)-3-propyl-pyrazolo[4,3-d]pyrimidine Formula: C23H19FN4 MolecularWeight: 370.422163

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C(N=C(N=C12)C3=CC=C(C=C3)F)C#CC4=CC=CC=C4)C

Isomeric SMILES

CCCC1=NN(C2=C(N=C(N=C12)C3=CC=C(C=C3)F)C#CC4=CC=CC=C4)C

InChI

InChI=1S/C23H19FN4/c1-3-7-19-21-22(28(2)27-19)20(15-10-16-8-5-4-6-9-16)25-23(26-21)17-11-13-18(24)14-12-17/h4-6,8-9,11-14H,3,7H2,1-2H3