Vitas-M small molecule compound

N-{2,2,2-trichloro-1-[6-(morpholin-4-yl)-9H-purin-9-yl]ethyl}benzamide

Catalog ID
STK944678
SMILES O=C(c1ccccc1)NC(C(Cl)(Cl)Cl)n1cnc2c1ncnc2N1CCOCC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H17Cl3N6O2 MW 455.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl3N6O2/c19-18(20,21)17(25-16(28)12-4-2-1-3-5-12)27-11-24-13-14(22-10-23-15(13)27)26-6-8-29-9-7-26/h1-5,10-11,17H,6-9H2,(H,25,28)
InChIKey
LMRBCYJZHSNLLE-UHFFFAOYSA-N
Synonyms

C1COCCN1C2=NC=NC3=C2N=CN3C(C(Cl)(Cl)Cl)NC(=O)C4=CC=CC=C4
InChI=1SC18H17Cl3N6O2c1918(2021)17(2516(28)124213512)2711241314(22102315(13)27)2668299726h15101117H69H2(H2528)
MFCD00496818
N(222trichloro1(6(morpholin4yl)9Hpurin9yl)ethyl)benzamide
N(222TRICHLORO1(6MORPHOLIN4YLPURIN9YL)ETHYL)BENZAMIDE
PHENYLN(222TRICHLORO1(6MORPHOLIN4YLPURIN9YL)ETHYL)CARBOXAMIDE
ZINC000000879765
ZINC000000879767

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Available files

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