7-tert-butyl-5-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-tert-butyl-5-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-tert-butyl-5-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-tert-butyl-5-[2-(4-ethoxyphenoxy)ethylthio]-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-tert-butyl-5-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-tert-butyl-5-[2-(4-ethoxyphenoxy)ethylthio]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C(C)(C)C

InChI

InChI=1S/C22H28N4O4S/c1-7-29-14-8-10-15(11-9-14)30-12-13-31-18-16-17(23-20(24-18)22(2,3)4)25(5)21(28)26(6)19(16)27/h8-11H,7,12-13H2,1-6H3