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

Systemtic Name: 5,6-dimethyl-7-phenyl-4-pyrrolidin-1-yl-pyrrolo[2,3-d]pyrimidine-2-carboxylic acid Openeye Name: 5,6-dimethyl-7-phenyl-4-pyrrolidin-1-yl-pyrrolo[2,3-d]pyrimidine-2-carboxylic acid CAS Name: 5,6-dimethyl-7-phenyl-4-(1-pyrrolidinyl)-2-pyrrolo[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5,6-dimethyl-7-phenyl-4-pyrrolidin-1-ylpyrrolo[2,3-d]pyrimidine-2-carboxylic acid Traditional Name: 5,6-dimethyl-7-phenyl-4-pyrrolidino-pyrrolo[2,3-d]pyrimidine-2-carboxylic acid Formula: C19H20N4O2 MolecularWeight: 336.3877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=NC(=N2)C(=O)O)N3CCCC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(N(C2=C1C(=NC(=N2)C(=O)O)N3CCCC3)C4=CC=CC=C4)C

InChI

InChI=1S/C19H20N4O2/c1-12-13(2)23(14-8-4-3-5-9-14)18-15(12)17(22-10-6-7-11-22)20-16(21-18)19(24)25/h3-5,8-9H,6-7,10-11H2,1-2H3,(H,24,25)