Vitas-M small molecule compound
8-(3-ethoxypropyl)-1,3-dimethyl-7-(4-nitrophenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Catalog ID
STL071080
SMILES CCOCCCn1c(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 C20H22N6O5 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O5/c1-4-31-11-5-10-24-15(13-6-8-14(9-7-13)26(29)30)12-25-16-17(21-19(24)25)22(2)20(28)23(3)18(16)27/h6-9,12H,4-5,10-11H2,1-3H3InChIKey
IBLLIDVZAFQJDQ-UHFFFAOYSA-NSynonyms
714935-08-76(3ETHOXYPROPYL)24DIMETHYL7(4NITROPHENYL)PURINO(78A)IMIDAZOLE13DIONE
714935087
8(3ethoxypropyl)13dimethyl7(4nitrophenyl)1Himidazo(21f)purine24(3H8H)dione
CCOCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)(N+)(=O)(O)
CCOCCCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H22N6O5c1431115102415(136814(9713)26(29)30)12251617(2119(24)25)22(2)20(28)23(3)18(16)27h6912H451011H213H3
MFCD04158245
ZINC000013758683
ZINC13758683
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