1,3-dimethyl-7-phenyl-5-propan-2-ylsulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-7-phenyl-5-propan-2-ylsulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-isopropylsulfanyl-1,3-dimethyl-7-phenyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-7-phenyl-5-(propan-2-ylthio)pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-7-phenyl-5-propan-2-ylsulfanylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-(isopropylthio)-1,3-dimethyl-7-phenyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C17H18N4O2S MolecularWeight: 342.41542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC(=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=CC=C3

Isomeric SMILES

CC(C)SC1=NC(=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4O2S/c1-10(2)24-15-12-14(20(3)17(23)21(4)16(12)22)18-13(19-15)11-8-6-5-7-9-11/h5-10H,1-4H3