methyl 1-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[3-(3-cyano-5,7-dimethyl-6-pyrazolo[1,5-a]pyrimidinyl)-1-oxopropyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(3-cyano-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)propanoyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoyl]-4-phenyl-isonipecotic acid methyl ester Formula: C25H27N5O3 MolecularWeight: 445.51358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C(C=NN12)C#N)C)CCC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=C(C=NN12)C#N)C)CCC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H27N5O3/c1-17-21(18(2)30-23(28-17)19(15-26)16-27-30)9-10-22(31)29-13-11-25(12-14-29,24(32)33-3)20-7-5-4-6-8-20/h4-8,16H,9-14H2,1-3H3