3-[2,6-bis(chloranyl)phenyl]-7-methylsulfanyl-1-propan-2-yl-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-[2,6-bis(chloranyl)phenyl]-7-methylsulfanyl-1-propan-2-yl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 3-(2,6-dichlorophenyl)-1-isopropyl-7-methylsulfanyl-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 3-(2,6-dichlorophenyl)-7-(methylthio)-1-propan-2-yl-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 3-(2,6-dichlorophenyl)-7-methylsulfanyl-1-propan-2-yl-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 3-(2,6-dichlorophenyl)-1-isopropyl-7-(methylthio)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C16H16Cl2N4OS MolecularWeight: 383.29544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC=C3Cl)Cl)SC

Isomeric SMILES

CC(C)N1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC=C3Cl)Cl)SC

InChI

InChI=1S/C16H16Cl2N4OS/c1-9(2)22-14-10(7-19-15(20-14)24-3)8-21(16(22)23)13-11(17)5-4-6-12(13)18/h4-7,9H,8H2,1-3H3