Vitas-M small molecule compound
{1,7-dimethyl-2,4-dioxo-3-[(2E)-3-phenylprop-2-en-1-yl]-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl}acetic acid
Catalog ID
STL519272
SMILES OC(=O)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C/C=C/c1ccccc1
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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 C20H19N5O4 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O4/c1-13-11-25-16-17(21-19(25)24(13)12-15(26)27)22(2)20(29)23(18(16)28)10-6-9-14-7-4-3-5-8-14/h3-9,11H,10,12H2,1-2H3,(H,26,27)/b9-6+InChIKey
JFNXJAFMIOZCBZ-RMKNXTFCSA-NSynonyms
1021077-23-5(17dimethyl24dioxo3((2E)3phenylprop2en1yl)1234tetrahydro8Himidazo(21f)purin8yl)aceticacid
(E)2(3CINNAMYL17DIMETHYL24DIOXO34DIHYDRO1HIMIDAZO(21F)PURIN8(2H)YL)ACETICACID
1021077235
2(3((2E)3PHENYLPROP2ENYL)17DIMETHYL24DIOXO135TRIHYDRO4IMIDAZOLINO(12H)PURIN8YL)ACETICACID
2(47dimethyl13dioxo2((~(E))3phenylprop2enyl)purino(78a)imidazol6yl)aceticacid
42506700
InChI=1SC20H19N5O4c11311251617(2119(25)24(13)1215(26)27)22(2)20(29)23(18(16)28)1069147435814h3911H1012H212H3(H2627)b96+
MFCD12028876
OC(=O)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CC=Cc1ccccc1
ZINC000012296449
ZINC12296449
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