Vitas-M small molecule compound

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

Catalog ID
STL049807
SMILES CCCCCn1c(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 C20H22N6O4 MW 410.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O4/c1-4-5-6-11-24-15(13-7-9-14(10-8-13)26(29)30)12-25-16-17(21-19(24)25)22(2)20(28)23(3)18(16)27/h7-10,12H,4-6,11H2,1-3H3
InChIKey
WFPLFIZLWQQTJF-UHFFFAOYSA-N
Synonyms
714939-41-0
13dimethyl7(4nitrophenyl)8pentyl1Himidazo(21f)purine24(3H8H)dione
24DIMETHYL7(4NITROPHENYL)6PENTYLPURINO(78A)IMIDAZOLE13DIONE
714939410
CCCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)(N+)(=O)(O)
CCCCCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H22N6O4c1456112415(137914(10813)26(29)30)12251617(2119(24)25)22(2)20(28)23(3)18(16)27h71012H4611H213H3
MFCD04187171
ZINC000008625518
ZINC08625518
ZINC8625518

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Available files

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