Vitas-M small molecule compound
2-[1-{2-[(2-bromo-4-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl]-N-cyclopentylacetamide
Catalog ID
STL190475
SMILES O=C(Cn1c(=O)n(CC(=O)NC2CCCC2)c(=O)c2c1c1ccccc1o2)Nc1ccc(cc1Br)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 C26H25BrN4O5 MW 553.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25BrN4O5/c1-15-10-11-19(18(27)12-15)29-22(33)13-30-23-17-8-4-5-9-20(17)36-24(23)25(34)31(26(30)35)14-21(32)28-16-6-2-3-7-16/h4-5,8-12,16H,2-3,6-7,13-14H2,1H3,(H,28,32)(H,29,33)InChIKey
XVTCLCUBBXBWJH-UHFFFAOYSA-NSynonyms
2(1(2((2bromo4methylphenyl)amino)2oxoethyl)24dioxo14dihydro(1)benzofuro(32d)pyrimidin3(2H)yl)Ncyclopentylacetamide
CC1=CC(=C(C=C1)NC(=O)CN2C3=C(C(=O)N(C2=O)CC(=O)NC4CCCC4)OC5=CC=CC=C53)Br
InChI=1SC26H25BrN4O5c115101119(18(27)1215)2922(33)13302317845920(17)3624(23)25(34)31(26(30)35)1421(32)2816623716h4581216H23671314H21H3(H2832)(H2933)
MFCD22389814
N(2bromo4methylphenyl)2(3(2(cyclopentylamino)2oxoethyl)24dioxo(1)benzofuro(32d)pyrimidin1yl)acetamide
ZINC000101354050
ZINC101354050
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