6-[2,6-bis(chloranyl)phenyl]-2-[[4-[3-(2-hydroxyethyloxy)azetidin-1-yl]phenyl]amino]-8H-pyrimido[4,5-d]pyrimidine-5,7-dione

Systemtic Name: 6-[2,6-bis(chloranyl)phenyl]-2-[[4-[3-(2-hydroxyethyloxy)azetidin-1-yl]phenyl]amino]-8H-pyrimido[4,5-d]pyrimidine-5,7-dione Openeye Name: 6-(2,6-dichlorophenyl)-2-[4-[3-(2-hydroxyethoxy)azetidin-1-yl]anilino]-8H-pyrimido[4,5-d]pyrimidine-5,7-dione CAS Name: 6-(2,6-dichlorophenyl)-2-[4-[3-(2-hydroxyethoxy)-1-azetidinyl]anilino]-8H-pyrimido[4,5-d]pyrimidine-5,7-dione IUPAC Name: 6-(2,6-dichlorophenyl)-2-[4-[3-(2-hydroxyethoxy)azetidin-1-yl]anilino]-8H-pyrimido[4,5-d]pyrimidine-5,7-dione Traditional Name: 6-(2,6-dichlorophenyl)-2-[4-[3-(2-hydroxyethoxy)azetidin-1-yl]anilino]-8H-pyrimido[4,5-d]pyrimidine-5,7-quinone Formula: C23H20Cl2N6O4 MolecularWeight: 515.3487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C2=CC=C(C=C2)NC3=NC=C4C(=N3)NC(=O)N(C4=O)C5=C(C=CC=C5Cl)Cl)OCCO

Isomeric SMILES

C1C(CN1C2=CC=C(C=C2)NC3=NC=C4C(=N3)NC(=O)N(C4=O)C5=C(C=CC=C5Cl)Cl)OCCO

InChI

InChI=1S/C23H20Cl2N6O4/c24-17-2-1-3-18(25)19(17)31-21(33)16-10-26-22(28-20(16)29-23(31)34)27-13-4-6-14(7-5-13)30-11-15(12-30)35-9-8-32/h1-7,10,15,32H,8-9,11-12H2,(H2,26,27,28,29,34)