methyl 4-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoylamino]butanoate

Systemtic Name: methyl 4-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoylamino]butanoate Openeye Name: methyl 4-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoylamino]butanoate CAS Name: 4-[[3-(3-cyano-5,7-dimethyl-6-pyrazolo[1,5-a]pyrimidinyl)-1-oxopropyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[3-(3-cyano-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)propanoylamino]butanoate Traditional Name: 4-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoylamino]butyric acid methyl ester Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C(C=NN12)C#N)C)CCC(=O)NCCCC(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=C(C=NN12)C#N)C)CCC(=O)NCCCC(=O)OC

InChI

InChI=1S/C17H21N5O3/c1-11-14(6-7-15(23)19-8-4-5-16(24)25-3)12(2)22-17(21-11)13(9-18)10-20-22/h10H,4-8H2,1-3H3,(H,19,23)