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

Systemtic Name: 5-[2-(2,5-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-[2-(2,5-dimethoxyphenyl)-2-oxo-ethyl]sulfanyl-7-isopropyl-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 5-[[2-(2,5-dimethoxyphenyl)-2-oxoethyl]thio]-3-methyl-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 5-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl-3-methyl-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-[[2-(2,5-dimethoxyphenyl)-2-keto-ethyl]thio]-7-isopropyl-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C23H28N4O5S MolecularWeight: 472.55722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O5S/c1-7-10-27-20-18(22(29)26(4)23(27)30)21(25-19(24-20)13(2)3)33-12-16(28)15-11-14(31-5)8-9-17(15)32-6/h8-9,11,13H,7,10,12H2,1-6H3