Vitas-M small molecule compound
2-{3-[2-(cyclopentylamino)-2-oxoethyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STL190459
SMILES O=C(Cn1c(=O)n(CC(=O)NC2CCCC2)c(=O)c2c1c1ccccc1o2)Nc1ccc2c(c1)OCCO2
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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 C27H26N4O7 MW 518.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O7/c32-22(29-17-9-10-20-21(13-17)37-12-11-36-20)14-30-24-18-7-3-4-8-19(18)38-25(24)26(34)31(27(30)35)15-23(33)28-16-5-1-2-6-16/h3-4,7-10,13,16H,1-2,5-6,11-12,14-15H2,(H,28,33)(H,29,32)InChIKey
ACXAUCKLYPSBQU-UHFFFAOYSA-NSynonyms
2(3(2(cyclopentylamino)2oxoethyl)24dioxo(1)benzofuro(32d)pyrimidin1yl)N(23dihydro14benzodioxin6yl)acetamide
2(3(2(cyclopentylamino)2oxoethyl)24dioxo34dihydro(1)benzofuro(32d)pyrimidin1(2H)yl)N(23dihydro14benzodioxin6yl)acetamide
C1CCC(C1)NC(=O)CN2C(=O)C3=C(C4=CC=CC=C4O3)N(C2=O)CC(=O)NC5=CC6=C(C=C5)OCCO6
InChI=1SC27H26N4O7c3222(29179102021(1317)3712113620)14302418734819(18)3825(24)26(34)31(27(30)35)1523(33)2816512616h347101316H125611121415H2(H2833)(H2932)
MFCD22389798
ZINC000072332068
ZINC72332068
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