Vitas-M small molecule compound
8-(4-chlorobenzyl)-1,3-dimethyl-7-(4-nitrophenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Catalog ID
STL049682
SMILES Clc1ccc(cc1)Cn1c(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 C22H17ClN6O4 MW 464.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN6O4/c1-25-19-18(20(30)26(2)22(25)31)28-12-17(14-5-9-16(10-6-14)29(32)33)27(21(28)24-19)11-13-3-7-15(23)8-4-13/h3-10,12H,11H2,1-2H3InChIKey
SYGICFFRFPXNPR-UHFFFAOYSA-NSynonyms
713126-28-46((4CHLOROPHENYL)METHYL)24DIMETHYL7(4NITROPHENYL)PURINO(78A)IMIDAZOLE13DIONE
713126284
8(4chlorobenzyl)13dimethyl7(4nitrophenyl)1Himidazo(21f)purine24(3H8H)dione
Clc1ccc(cc1)Cn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)(N+)(=O)(O)
CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CC4=CC=C(C=C4)Cl)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC22H17ClN6O4c1251918(20(30)26(2)22(25)31)281217(145916(10614)29(32)33)27(21(28)2419)11133715(23)8413h31012H11H212H3
MFCD04186904
ZINC000009160534
ZINC09160534
ZINC9160534
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