2-(2-dimethylaminoethylamino)-5-(4-fluorophenyl)pyrimidine-4-carboxylic acid

Systemtic Name: 2-(2-dimethylaminoethylamino)-5-(4-fluorophenyl)pyrimidine-4-carboxylic acid Openeye Name: 2-(2-dimethylaminoethylamino)-5-(4-fluorophenyl)pyrimidine-4-carboxylic acid CAS Name: 2-(2-dimethylaminoethylamino)-5-(4-fluorophenyl)-4-pyrimidinecarboxylic acid IUPAC Name: 2-(2-dimethylaminoethylamino)-5-(4-fluorophenyl)pyrimidine-4-carboxylic acid Traditional Name: 2-(2-dimethylaminoethylamino)-5-(4-fluorophenyl)pyrimidine-4-carboxylic acid Formula: C15H17FN4O2 MolecularWeight: 304.319483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=NC=C(C(=N1)C(=O)O)C2=CC=C(C=C2)F

Isomeric SMILES

CN(C)CCNC1=NC=C(C(=N1)C(=O)O)C2=CC=C(C=C2)F

InChI

InChI=1S/C15H17FN4O2/c1-20(2)8-7-17-15-18-9-12(13(19-15)14(21)22)10-3-5-11(16)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,21,22)(H,17,18,19)