3-methyl-5-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 3-methyl-5-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-isopropyl-3-methyl-5-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 3-methyl-5-[[2-(4-methylphenyl)-2-oxoethyl]thio]-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 3-methyl-5-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-isopropyl-5-[[2-keto-2-(p-tolyl)ethyl]thio]-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C(C)C)SCC(=O)C3=CC=C(C=C3)C)C(=O)N(C1=O)C

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C(C)C)SCC(=O)C3=CC=C(C=C3)C)C(=O)N(C1=O)C

InChI

InChI=1S/C22H26N4O3S/c1-6-11-26-19-17(21(28)25(5)22(26)29)20(24-18(23-19)13(2)3)30-12-16(27)15-9-7-14(4)8-10-15/h7-10,13H,6,11-12H2,1-5H3