(2-oxidanylidene-2-phenylazanyl-ethyl) 3-(2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl)propanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 3-(2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl)propanoate Openeye Name: (2-anilino-2-oxo-ethyl) 3-(2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl)propanoate CAS Name: 3-(2,5,7-trimethyl-6-pyrazolo[1,5-a]pyrimidinyl)propanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 3-(2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl)propanoate Traditional Name: 3-(2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl)propionic acid (2-anilino-2-keto-ethyl) ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=C(C(=NC2=C1)C)CCC(=O)OCC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=NN2C(=C(C(=NC2=C1)C)CCC(=O)OCC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C20H22N4O3/c1-13-11-18-21-14(2)17(15(3)24(18)23-13)9-10-20(26)27-12-19(25)22-16-7-5-4-6-8-16/h4-8,11H,9-10,12H2,1-3H3,(H,22,25)