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

Systemtic Name: 7-(3,5-dimethylphenyl)-1,3-dimethyl-5-prop-2-enylsulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-allylsulfanyl-7-(3,5-dimethylphenyl)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-(3,5-dimethylphenyl)-1,3-dimethyl-5-(prop-2-enylthio)pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-(3,5-dimethylphenyl)-1,3-dimethyl-5-prop-2-enylsulfanylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-(allylthio)-7-(3,5-dimethylphenyl)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C19H20N4O2S MolecularWeight: 368.4527

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NC3=C(C(=N2)SCC=C)C(=O)N(C(=O)N3C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NC3=C(C(=N2)SCC=C)C(=O)N(C(=O)N3C)C)C

InChI

InChI=1S/C19H20N4O2S/c1-6-7-26-17-14-16(22(4)19(25)23(5)18(14)24)20-15(21-17)13-9-11(2)8-12(3)10-13/h6,8-10H,1,7H2,2-5H3