Vitas-M small molecule compound
N-cyclopentyl-2-[1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2,4-dioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl]acetamide
Catalog ID
STL190461
SMILES COc1ccc(cc1)N1CCN(CC1)C(=O)Cn1c(=O)n(CC(=O)NC2CCCC2)c(=O)c2c1c1ccccc1o2
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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 C30H33N5O6 MW 559.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N5O6/c1-40-22-12-10-21(11-13-22)32-14-16-33(17-15-32)26(37)19-34-27-23-8-4-5-9-24(23)41-28(27)29(38)35(30(34)39)18-25(36)31-20-6-2-3-7-20/h4-5,8-13,20H,2-3,6-7,14-19H2,1H3,(H,31,36)InChIKey
LPKJOJSMQBXLBU-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CN3C4=C(C(=O)N(C3=O)CC(=O)NC5CCCC5)OC6=CC=CC=C64
InChI=1SC30H33N5O6c14022121021(111322)32141633(171532)26(37)19342723845924(23)4128(27)29(38)35(30(34)39)1825(36)3120623720h4581320H23671419H21H3(H3136)
MFCD22389800
Ncyclopentyl2(1(2(4(4methoxyphenyl)piperazin1yl)2oxoethyl)24dioxo(1)benzofuro(32d)pyrimidin3yl)acetamide
Ncyclopentyl2(1(2(4(4methoxyphenyl)piperazin1yl)2oxoethyl)24dioxo14dihydro(1)benzofuro(32d)pyrimidin3(2H)yl)acetamide
ZINC000101354060
ZINC101354060
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