5-(2-hydroxyethylsulfanyl)-1,3-dimethyl-7-(2-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 5-(2-hydroxyethylsulfanyl)-1,3-dimethyl-7-(2-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-(2-hydroxyethylsulfanyl)-1,3-dimethyl-7-(o-tolyl)pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 5-(2-hydroxyethylthio)-1,3-dimethyl-7-(2-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 5-(2-hydroxyethylsulfanyl)-1,3-dimethyl-7-(2-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-(2-hydroxyethylthio)-1,3-dimethyl-7-(o-tolyl)pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C(=N2)SCCO)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C(=N2)SCCO)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H18N4O3S/c1-10-6-4-5-7-11(10)13-18-14-12(15(19-13)25-9-8-22)16(23)21(3)17(24)20(14)2/h4-7,22H,8-9H2,1-3H3