Vitas-M small molecule compound
7-(3-chloro-2-methylphenyl)-2-cyclohexylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Catalog ID
STL199033
SMILES Clc1cccc(c1C)n1ccc2c(c1=O)cnc1n2nc(n1)C1CCCCC1
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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 C21H20ClN5O MW 393.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O/c1-13-16(22)8-5-9-17(13)26-11-10-18-15(20(26)28)12-23-21-24-19(25-27(18)21)14-6-3-2-4-7-14/h5,8-12,14H,2-4,6-7H2,1H3InChIKey
ZAKDTDLDSMHRRK-UHFFFAOYSA-NSynonyms
7(3chloro2methylphenyl)2cyclohexylpyrido(34e)(124)triazolo(15a)pyrimidin6(7H)one
CC1=C(C=CC=C1Cl)N2C=CC3=C(C2=O)C=NC4=NC(=NN34)C5CCCCC5
InChI=1SC21H20ClN5Oc11316(22)85917(13)2611101815(20(26)28)1223212419(2527(18)21)146324714h581214H2467H21H3
MFCD20503703
ZINC000071375959
ZINC71375959
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