ethyl 5,6-dimethyl-7-phenyl-4-pyrrolidin-1-yl-pyrrolo[2,3-d]pyrimidine-2-carboxylate

Systemtic Name: ethyl 5,6-dimethyl-7-phenyl-4-pyrrolidin-1-yl-pyrrolo[2,3-d]pyrimidine-2-carboxylate Openeye Name: ethyl 5,6-dimethyl-7-phenyl-4-pyrrolidin-1-yl-pyrrolo[2,3-d]pyrimidine-2-carboxylate CAS Name: 5,6-dimethyl-7-phenyl-4-(1-pyrrolidinyl)-2-pyrrolo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5,6-dimethyl-7-phenyl-4-pyrrolidin-1-ylpyrrolo[2,3-d]pyrimidine-2-carboxylate Traditional Name: 5,6-dimethyl-7-phenyl-4-pyrrolidino-pyrrolo[2,3-d]pyrimidine-2-carboxylic acid ethyl ester Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C(=C(N2C3=CC=CC=C3)C)C)C(=N1)N4CCCC4

Isomeric SMILES

CCOC(=O)C1=NC2=C(C(=C(N2C3=CC=CC=C3)C)C)C(=N1)N4CCCC4

InChI

InChI=1S/C21H24N4O2/c1-4-27-21(26)18-22-19(24-12-8-9-13-24)17-14(2)15(3)25(20(17)23-18)16-10-6-5-7-11-16/h5-7,10-11H,4,8-9,12-13H2,1-3H3