4-[(4-methoxyphenyl)methylamino]-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxylic acid

Systemtic Name: 4-[(4-methoxyphenyl)methylamino]-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxylic acid Openeye Name: 4-[(4-methoxyphenyl)methylamino]-2-(2-methylindolin-1-yl)pyrimidine-5-carboxylic acid CAS Name: 4-[(4-methoxyphenyl)methylamino]-2-(2-methyl-2,3-dihydroindol-1-yl)-5-pyrimidinecarboxylic acid IUPAC Name: 4-[(4-methoxyphenyl)methylamino]-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxylic acid Traditional Name: 2-(2-methylindolin-1-yl)-4-(p-anisylamino)pyrimidine-5-carboxylic acid Formula: C22H22N4O3 MolecularWeight: 390.43508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=NC=C(C(=N3)NCC4=CC=C(C=C4)OC)C(=O)O

Isomeric SMILES

CC1CC2=CC=CC=C2N1C3=NC=C(C(=N3)NCC4=CC=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C22H22N4O3/c1-14-11-16-5-3-4-6-19(16)26(14)22-24-13-18(21(27)28)20(25-22)23-12-15-7-9-17(29-2)10-8-15/h3-10,13-14H,11-12H2,1-2H3,(H,27,28)(H,23,24,25)