3-(2-ethyl-5,7-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid

Systemtic Name: 3-(2-ethyl-5,7-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid Openeye Name: 3-(2-ethyl-5,7-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid CAS Name: 3-(2-ethyl-5,7-dimethyl-3-phenyl-6-pyrazolo[1,5-a]pyrimidinyl)propanoic acid IUPAC Name: 3-(2-ethyl-5,7-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid Traditional Name: 3-(2-ethyl-5,7-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propionic acid Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN2C(=C(C(=NC2=C1C3=CC=CC=C3)C)CCC(=O)O)C

Isomeric SMILES

CCC1=NN2C(=C(C(=NC2=C1C3=CC=CC=C3)C)CCC(=O)O)C

InChI

InChI=1S/C19H21N3O2/c1-4-16-18(14-8-6-5-7-9-14)19-20-12(2)15(10-11-17(23)24)13(3)22(19)21-16/h5-9H,4,10-11H2,1-3H3,(H,23,24)