ethyl (7R)-7-(4-chlorophenyl)-3-cyano-5-methyl-2-pyrrolidin-1-yl-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl (7R)-7-(4-chlorophenyl)-3-cyano-5-methyl-2-pyrrolidin-1-yl-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl (7R)-7-(4-chlorophenyl)-3-cyano-5-methyl-2-pyrrolidin-1-yl-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: (7R)-7-(4-chlorophenyl)-3-cyano-5-methyl-2-(1-pyrrolidinyl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (7R)-7-(4-chlorophenyl)-3-cyano-5-methyl-2-pyrrolidin-1-yl-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: (7R)-7-(4-chlorophenyl)-3-cyano-5-methyl-2-pyrrolidino-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H22ClN5O2 MolecularWeight: 411.88468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C(=C(NN2C1C3=CC=C(C=C3)Cl)N4CCCC4)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2C(=C(NN2[C@@H]1C3=CC=C(C=C3)Cl)N4CCCC4)C#N)C

InChI

InChI=1S/C21H22ClN5O2/c1-3-29-21(28)17-13(2)24-19-16(12-23)20(26-10-4-5-11-26)25-27(19)18(17)14-6-8-15(22)9-7-14/h6-9,18,25H,3-5,10-11H2,1-2H3/t18-/m1/s1