Chemical Component Summary

NameN-tert-butyl-2-{4-[(5,5-dioxido-2-phenyl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-4-yl)amino]phenyl}acetamide
Identifiers2-[4-[[5,5-bis(oxidanylidene)-2-phenyl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-4-yl]amino]phenyl]-N-tert-butyl-ethanamide
FormulaC25 H28 N4 O3 S
Molecular Weight464.58
TypeNON-POLYMER
Isomeric SMILESCC(C)(C)NC(=O)Cc1ccc(cc1)Nc2c3c(nc(n2)c4ccccc4)CCCS3(=O)=O
InChIInChI=1S/C25H28N4O3S/c1-25(2,3)29-21(30)16-17-11-13-19(14-12-17)26-24-22-20(10-7-15-33(22,31)32)27-23(28-24)18-8-5-4-6-9-18/h4-6,8-9,11-14H,7,10,15-16H2,1-3H3,(H,29,30)(H,26,27,28)
InChIKeyIHIZFBWFXODXJS-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count61
Chiral Atom Count0
Bond Count64
Aromatic Bond Count18

Related Resource References

Resource NameReference
Pharos CHEMBL2385758
PubChem 71463568
ChEMBL CHEMBL2385758