7-cyclohexyl-6-[4-(furan-3-yl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid

Systemtic Name: 7-cyclohexyl-6-[4-(furan-3-yl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Openeye Name: 7-cyclohexyl-6-[4-(3-furyl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid CAS Name: 7-cyclohexyl-6-[4-(3-furanyl)phenyl]-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 7-cyclohexyl-6-[4-(furan-3-yl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Traditional Name: 7-cyclohexyl-6-[4-(3-furyl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=NC3=C(C=NN23)C(=O)O)C4=CC=C(C=C4)C5=COC=C5

Isomeric SMILES

C1CCC(CC1)C2=C(C=NC3=C(C=NN23)C(=O)O)C4=CC=C(C=C4)C5=COC=C5

InChI

InChI=1S/C23H21N3O3/c27-23(28)20-13-25-26-21(17-4-2-1-3-5-17)19(12-24-22(20)26)16-8-6-15(7-9-16)18-10-11-29-14-18/h6-14,17H,1-5H2,(H,27,28)