Vitas-M small molecule compound
2-[3-(4-chlorobenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-cyclohexyl-N-methylacetamide
Catalog ID
STK879165
SMILES Clc1ccc(cc1)Cn1nnc2c1ncn(c2=O)CC(=O)N(C1CCCCC1)C
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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 C20H23ClN6O2 MW 414.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN6O2/c1-25(16-5-3-2-4-6-16)17(28)12-26-13-22-19-18(20(26)29)23-24-27(19)11-14-7-9-15(21)10-8-14/h7-10,13,16H,2-6,11-12H2,1H3InChIKey
QIVSSJBFJIBFBU-UHFFFAOYSA-NSynonyms
1223880-44-11223880441
2(3((4chlorophenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)NcyclohexylNmethylacetamide
2(3(4chlorobenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)NcyclohexylNmethylacetamide
CN(C1CCCCC1)C(=O)CN2C=NC3=C(C2=O)N=NN3CC4=CC=C(C=C4)Cl
InChI=1SC20H23ClN6O2c125(165324616)17(28)122613221918(20(26)29)232427(19)11147915(21)10814h7101316H261112H21H3
MFCD18170549
ZINC000040477992
ZINC40477992
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