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219580-11-7 molecular structure
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3-tert-butyl-1-(2-{[4-(diethylamino)butyl]amino}-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl)urea

ChemBase ID: 72601
Molecular Formular: C28H41N7O3
Molecular Mass: 523.67024
Monoisotopic Mass: 523.32708821
SMILES and InChIs

SMILES:
n1c(nc2c(c1)cc(c(n2)NC(=O)NC(C)(C)C)c1cc(cc(c1)OC)OC)NCCCCN(CC)CC
Canonical SMILES:
CCN(CCCCNc1ncc2c(n1)nc(c(c2)c1cc(OC)cc(c1)OC)NC(=O)NC(C)(C)C)CC
InChI:
InChI=1S/C28H41N7O3/c1-8-35(9-2)13-11-10-12-29-26-30-18-20-16-23(19-14-21(37-6)17-22(15-19)38-7)25(31-24(20)32-26)33-27(36)34-28(3,4)5/h14-18H,8-13H2,1-7H3,(H3,29,30,31,32,33,34,36)
InChIKey:
DXCUKNQANPLTEJ-UHFFFAOYSA-N

Cite this record

CBID:72601 http://www.chembase.cn/molecule-72601.html

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