Vitas-M small molecule compound
3-(3-chloro-4-methylphenyl)-5-methyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl acetate
Catalog ID
STK716043
SMILES CC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)C)cccc3)c1ccc(c(c1)Cl)C
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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 C22H17ClN4O2 MW 404.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN4O2/c1-12-8-9-15(10-16(12)23)26-11-19(29-14(3)28)20-21(26)24-13(2)27-18-7-5-4-6-17(18)25-22(20)27/h4-11H,1-3H3InChIKey
QDXMZKNNGGXQSD-UHFFFAOYSA-NSynonyms
885193-50-03(3chloro4methylphenyl)5methyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylacetate
3(3chloro4methylphenyl)5methyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylacetate
885193500
CC1=C(C=C(C=C1)N2C=C(C3=C2N=C(N4C3=NC5=CC=CC=C54)C)OC(=O)C)Cl
InChI=1SC22H17ClN4O2c1128915(1016(12)23)261119(2914(3)28)2021(26)2413(2)2718754617(18)2522(20)27h411H13H3
MFCD06607798
ZINC000002337748
ZINC02337748
ZINC2337748
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