7-(3,4-dimethoxyphenyl)-1,3-dimethyl-5-prop-2-enylsulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-(3,4-dimethoxyphenyl)-1,3-dimethyl-5-prop-2-enylsulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-allylsulfanyl-7-(3,4-dimethoxyphenyl)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-(3,4-dimethoxyphenyl)-1,3-dimethyl-5-(prop-2-enylthio)pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-(3,4-dimethoxyphenyl)-1,3-dimethyl-5-prop-2-enylsulfanylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-(allylthio)-7-(3,4-dimethoxyphenyl)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)C3=CC(=C(C=C3)OC)OC)SCC=C)C(=O)N(C1=O)C

Isomeric SMILES

CN1C2=C(C(=NC(=N2)C3=CC(=C(C=C3)OC)OC)SCC=C)C(=O)N(C1=O)C

InChI

InChI=1S/C19H20N4O4S/c1-6-9-28-17-14-16(22(2)19(25)23(3)18(14)24)20-15(21-17)11-7-8-12(26-4)13(10-11)27-5/h6-8,10H,1,9H2,2-5H3