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

Systemtic Name: 7-(3-methoxyphenyl)-1,3-dimethyl-5-propylsulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-(3-methoxyphenyl)-1,3-dimethyl-5-propylsulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-(3-methoxyphenyl)-1,3-dimethyl-5-(propylthio)pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-(3-methoxyphenyl)-1,3-dimethyl-5-propylsulfanylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-(3-methoxyphenyl)-1,3-dimethyl-5-(propylthio)pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCSC1=NC(=NC2=C1C(=O)N(C(=O)N2C)C)C3=CC(=CC=C3)OC

InChI

InChI=1S/C18H20N4O3S/c1-5-9-26-16-13-15(21(2)18(24)22(3)17(13)23)19-14(20-16)11-7-6-8-12(10-11)25-4/h6-8,10H,5,9H2,1-4H3