Vitas-M small molecule compound
3-(2-chlorobenzyl)-6-(3,4-difluorobenzyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Catalog ID
STL125820
SMILES Clc1ccccc1Cn1nnc2c1ncn(c2=O)Cc1ccc(c(c1)F)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 C18H12ClF2N5O MW 387.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12ClF2N5O/c19-13-4-2-1-3-12(13)9-26-17-16(23-24-26)18(27)25(10-22-17)8-11-5-6-14(20)15(21)7-11/h1-7,10H,8-9H2InChIKey
JTUAJDRPMAKXKX-UHFFFAOYSA-NSynonyms
1326868-24-91326868249
3((2chlorophenyl)methyl)6((34difluorophenyl)methyl)triazolo(45d)pyrimidin7one
3(2chlorobenzyl)6(34difluorobenzyl)36dihydro7H(123)triazolo(45d)pyrimidin7one
C1=CC=C(C(=C1)CN2C3=C(C(=O)N(C=N3)CC4=CC(=C(C=C4)F)F)N=N2)Cl
InChI=1SC18H12ClF2N5Oc1913421312(13)9261716(232426)18(27)25(102217)8115614(20)15(21)711h1710H89H2
MFCD20738246
ZINC000067259981
ZINC67259981
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