Vitas-M small molecule compound
2-[1-{2-[(5-chloro-2,4-dimethoxyphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl]-N-cyclopentylacetamide
Catalog ID
STL190434
SMILES COc1cc(OC)c(cc1NC(=O)Cn1c(=O)n(CC(=O)NC2CCCC2)c(=O)c2c1c1ccccc1o2)Cl
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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 C27H27ClN4O7 MW 554.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN4O7/c1-37-20-12-21(38-2)18(11-17(20)28)30-23(34)13-31-24-16-9-5-6-10-19(16)39-25(24)26(35)32(27(31)36)14-22(33)29-15-7-3-4-8-15/h5-6,9-12,15H,3-4,7-8,13-14H2,1-2H3,(H,29,33)(H,30,34)InChIKey
CHHZBUBZGNXCCQ-UHFFFAOYSA-NSynonyms
2(1(2((5chloro24dimethoxyphenyl)amino)2oxoethyl)24dioxo14dihydro(1)benzofuro(32d)pyrimidin3(2H)yl)Ncyclopentylacetamide
COC1=CC(=C(C=C1NC(=O)CN2C3=C(C(=O)N(C2=O)CC(=O)NC4CCCC4)OC5=CC=CC=C53)Cl)OC
InChI=1SC27H27ClN4O7c137201221(382)18(1117(20)28)3023(34)133124169561019(16)3925(24)26(35)32(27(31)36)1422(33)2915734815h5691215H34781314H212H3(H2933)(H3034)
MFCD22389773
N(5chloro24dimethoxyphenyl)2(3(2(cyclopentylamino)2oxoethyl)24dioxo(1)benzofuro(32d)pyrimidin1yl)acetamide
ZINC000101354075
ZINC101354075
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