Vitas-M small molecule compound
N-cyclopentyl-2-[1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-2,4-dioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl]acetamide
Catalog ID
STL190452
SMILES O=C(Cn1c(=O)n(CC(=O)N2CCN(CC2)c2ccc(cc2)F)c2c(c1=O)oc1c2cccc1)NC1CCCC1
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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 C29H30FN5O5 MW 547.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30FN5O5/c30-19-9-11-21(12-10-19)32-13-15-33(16-14-32)25(37)18-34-26-22-7-3-4-8-23(22)40-27(26)28(38)35(29(34)39)17-24(36)31-20-5-1-2-6-20/h3-4,7-12,20H,1-2,5-6,13-18H2,(H,31,36)InChIKey
DXJWRBVZEUQXFU-UHFFFAOYSA-NSynonyms
C1CCC(C1)NC(=O)CN2C(=O)C3=C(C4=CC=CC=C4O3)N(C2=O)CC(=O)N5CCN(CC5)C6=CC=C(C=C6)F
InChI=1SC29H30FN5O5c301991121(121019)32131533(161432)25(37)18342622734823(22)4027(26)28(38)35(29(34)39)1724(36)3120512620h3471220H12561318H2(H3136)
MFCD22389791
Ncyclopentyl2(1(2(4(4fluorophenyl)piperazin1yl)2oxoethyl)24dioxo(1)benzofuro(32d)pyrimidin3yl)acetamide
Ncyclopentyl2(1(2(4(4fluorophenyl)piperazin1yl)2oxoethyl)24dioxo14dihydro(1)benzofuro(32d)pyrimidin3(2H)yl)acetamide
ZINC000101354065
ZINC101354065
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