Vitas-M small molecule compound
3-(3-fluorobenzyl)-6-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Catalog ID
STK879437
SMILES Fc1ccc(cc1)N1CCN(CC1)C(=O)Cn1cnc2c(c1=O)nnn2Cc1cccc(c1)F
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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 C23H21F2N7O2 MW 465.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21F2N7O2/c24-17-4-6-19(7-5-17)29-8-10-30(11-9-29)20(33)14-31-15-26-22-21(23(31)34)27-28-32(22)13-16-2-1-3-18(25)12-16/h1-7,12,15H,8-11,13-14H2InChIKey
ONRASHMFYYHAFS-UHFFFAOYSA-NSynonyms
3((3fluorophenyl)methyl)6(2(4(4fluorophenyl)piperazin1yl)2oxoethyl)triazolo(45d)pyrimidin7one
3(3fluorobenzyl)6(2(4(4fluorophenyl)piperazin1yl)2oxoethyl)36dihydro7H(123)triazolo(45d)pyrimidin7one
C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CN3C=NC4=C(C3=O)N=NN4CC5=CC(=CC=C5)F
InChI=1SC23H21F2N7O2c24174619(7517)2981030(11929)20(33)143115262221(23(31)34)272832(22)131621318(25)1216h171215H8111314H2
MFCD18170774
ZINC000040478221
ZINC40478221
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