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

Systemtic Name: 5-[2-(3-bromanylphenoxy)ethylsulfanyl]-7-tert-butyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-[2-(3-bromophenoxy)ethylsulfanyl]-7-tert-butyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 5-[2-(3-bromophenoxy)ethylthio]-7-tert-butyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 5-[2-(3-bromophenoxy)ethylsulfanyl]-7-tert-butyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-[2-(3-bromophenoxy)ethylthio]-7-tert-butyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C20H23BrN4O3S MolecularWeight: 479.39062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C(=N1)SCCOC3=CC(=CC=C3)Br)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(C)(C)C1=NC2=C(C(=N1)SCCOC3=CC(=CC=C3)Br)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C20H23BrN4O3S/c1-20(2,3)18-22-15-14(17(26)25(5)19(27)24(15)4)16(23-18)29-10-9-28-13-8-6-7-12(21)11-13/h6-8,11H,9-10H2,1-5H3