Vitas-M small molecule compound
ethyl 3-[1-(butanoyloxy)-5-propyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-3-yl]benzoate
Catalog ID
STK716170
SMILES CCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCC)cccc3)c1cccc(c1)C(=O)OCC
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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 C28H28N4O4 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O4/c1-4-10-23-30-26-25(27-29-20-14-7-8-15-21(20)32(23)27)22(36-24(33)11-5-2)17-31(26)19-13-9-12-18(16-19)28(34)35-6-3/h7-9,12-17H,4-6,10-11H2,1-3H3InChIKey
ISZZNQKNDLVVKE-UHFFFAOYSA-NSynonyms
899385-54-7899385547
CCCC1=NC2=C(C(=CN2C3=CC=CC(=C3)C(=O)OCC)OC(=O)CCC)C4=NC5=CC=CC=C5N14
ethyl3(1(butanoyloxy)5propyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol3yl)benzoate
ethyl3(1(butyryloxy)5propyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin3yl)benzoate
InChI=1SC28H28N4O4c141023302625(27292014781521(20)32(23)27)22(3624(33)1152)1731(26)191391218(1619)28(34)3563h791217H461011H213H3
MFCD06604594
ZINC000009124012
ZINC09124012
ZINC9124012
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