1,9-Dihydro-9-[3-[[(4-methoxyphenyl)diphenylmethoxy]methyl]-4-[[(4-methylphenyl)sulfonyl]oxy]butyl]-2-[[(4-methoxyphenyl)diphenylmethyl]amino]-6H-purin-6-one
CAS Registry Number®
206067-84-7
CAS Name
1,9-Dihydro-9-[3-[[(4-methoxyphenyl)diphenylmethoxy]methyl]-4-[[(4-methylphenyl)sulfonyl]oxy]butyl]-2-[[(4-methoxyphenyl)diphenylmethyl]amino]-6H-purin-6-oneMolecular Formula
C57H53N5O7SMolecular Mass
952.12Cite this Page
1,9-Dihydro-9-[3-[[(4-methoxyphenyl)diphenylmethoxy]methyl]-4-[[(4-methylphenyl)sulfonyl]oxy]butyl]-2-[[(4-methoxyphenyl)diphenylmethyl]amino]-6H-purin-6-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=206067-84-7 (retrieved ) (CAS RN: 206067-84-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
200.2-203.8 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C57H53N5O7S/c1-41-24-34-51(35-25-41)70(64,65)69-39-42(38-68-57(46-20-12-6-13-21-46,47-22-14-7-15-23-47)48-28-32-50(67-3)33-29-48)36-37-62-40-58-52-53(62)59-55(60-54(52)63)61-56(43-16-8-4-9-17-43,44-18-10-5-11-19-44)45-26-30-49(66-2)31-27-45/h4-35,40,42H,36-39H2,1-3H3,(H2,59,60,61,63)
InChIKey
InChIKey=GWOKTINUYGXEEE-UHFFFAOYSA-N
SMILES
C(NC=1NC2=C(C(=O)N1)N=CN2CCC(COC(C3=CC=C(OC)C=C3)(C4=CC=CC=C4)C5=CC=CC=C5)COS(=O)(=O)C6=CC=C(C)C=C6)(C7=CC=C(OC)C=C7)(C8=CC=CC=C8)C9=CC=CC=C9
Canonical SMILES
O=C1N=C(NC2=C1N=CN2CCC(COC(C=3C=CC=CC3)(C=4C=CC=CC4)C5=CC=C(OC)C=C5)COS(=O)(=O)C6=CC=C(C=C6)C)NC(C=7C=CC=CC7)(C=8C=CC=CC8)C9=CC=C(OC)C=C9
Other Names for this Substance
- 6H-Purin-6-one, 1,9-dihydro-9-[3-[[(4-methoxyphenyl)diphenylmethoxy]methyl]-4-[[(4-methylphenyl)sulfonyl]oxy]butyl]-2-[[(4-methoxyphenyl)diphenylmethyl]amino]-
- 1,9-Dihydro-9-[3-[[(4-methoxyphenyl)diphenylmethoxy]methyl]-4-[[(4-methylphenyl)sulfonyl]oxy]butyl]-2-[[(4-methoxyphenyl)diphenylmethyl]amino]-6H-purin-6-one
Deleted or Replaced CAS Registry Numbers
1619245-50-9
