Vitas-M small molecule compound

3-(2-chlorobenzyl)-6-(2-chloro-4-fluorobenzyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

Catalog ID
STL125817
SMILES Fc1ccc(c(c1)Cl)Cn1cnc2c(c1=O)nnn2Cc1ccccc1Cl

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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 C18H12Cl2FN5O MW 404.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12Cl2FN5O/c19-14-4-2-1-3-11(14)9-26-17-16(23-24-26)18(27)25(10-22-17)8-12-5-6-13(21)7-15(12)20/h1-7,10H,8-9H2
InChIKey
WCUWMSRSPPVUGG-UHFFFAOYSA-N
Synonyms
1326875-69-7
1326875697
3(2chlorobenzyl)6(2chloro4fluorobenzyl)36dihydro7H(123)triazolo(45d)pyrimidin7one
6((2chloro4fluorophenyl)methyl)3((2chlorophenyl)methyl)triazolo(45d)pyrimidin7one
C1=CC=C(C(=C1)CN2C3=C(C(=O)N(C=N3)CC4=C(C=C(C=C4)F)Cl)N=N2)Cl
InChI=1SC18H12Cl2FN5Oc1914421311(14)9261716(232426)18(27)25(102217)8125613(21)715(12)20h1710H89H2
MFCD20738243
ZINC000067259976
ZINC67259976

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Available files

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