7-cyclohexyl-6-(2-ethyl-1-benzofuran-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Systemtic Name: 7-cyclohexyl-6-(2-ethyl-1-benzofuran-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Openeye Name: 7-cyclohexyl-6-(2-ethylbenzofuran-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid CAS Name: 7-cyclohexyl-6-(2-ethyl-5-benzofuranyl)-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 7-cyclohexyl-6-(2-ethyl-1-benzofuran-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Traditional Name: 7-cyclohexyl-6-(2-ethylbenzofuran-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Formula: C23H23N3O3 MolecularWeight: 389.44702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(O1)C=CC(=C2)C3=C(N4C(=CC(=N4)C(=O)O)N=C3)C5CCCCC5

Isomeric SMILES

CCC1=CC2=C(O1)C=CC(=C2)C3=C(N4C(=CC(=N4)C(=O)O)N=C3)C5CCCCC5

InChI

InChI=1S/C23H23N3O3/c1-2-17-11-16-10-15(8-9-20(16)29-17)18-13-24-21-12-19(23(27)28)25-26(21)22(18)14-6-4-3-5-7-14/h8-14H,2-7H2,1H3,(H,27,28)