Vitas-M small molecule compound

8-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-7-(4-nitrophenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione

Catalog ID
STL071302
SMILES COc1ccc(cc1OC)CCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)[N+](=O)[O-]

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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 C25H24N6O6 MW 504.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N6O6/c1-27-22-21(23(32)28(2)25(27)33)30-14-18(16-6-8-17(9-7-16)31(34)35)29(24(30)26-22)12-11-15-5-10-19(36-3)20(13-15)37-4/h5-10,13-14H,11-12H2,1-4H3
InChIKey
KYCWMNFGMCEOHW-UHFFFAOYSA-N
Synonyms
714938-70-2
6(2(34DIMETHOXYPHENYL)ETHYL)24DIMETHYL7(4NITROPHENYL)PURINO(78A)IMIDAZOLE13DIONE
714938702
8(2(34dimethoxyphenyl)ethyl)13dimethyl7(4nitrophenyl)1Himidazo(21f)purine24(3H8H)dione
8(34dimethoxyphenethyl)13dimethyl7(4nitrophenyl)1Himidazo(21f)purine24(3H8H)dione
CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCC4=CC(=C(C=C4)OC)OC)C5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc(cc1OC)CCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H24N6O6c1272221(23(32)28(2)25(27)33)301418(166817(9716)31(34)35)29(24(30)2622)12111551019(363)20(1315)374h5101314H1112H214H3
MFCD04178202
ZINC000009009095
ZINC09009095
ZINC9009095

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Available files

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