Vitas-M small molecule compound
3-(4-chlorophenyl)-2-(methoxymethyl)-7-[2-(thiophen-2-yl)ethyl]pyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one
Catalog ID
STL198080
SMILES COCc1nn2c(c1c1ccc(cc1)Cl)nnc1c2ccn(c1=O)CCc1cccs1
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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 C22H18ClN5O2S MW 451.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN5O2S/c1-30-13-17-19(14-4-6-15(23)7-5-14)21-25-24-20-18(28(21)26-17)9-11-27(22(20)29)10-8-16-3-2-12-31-16/h2-7,9,11-12H,8,10,13H2,1H3InChIKey
OCXFYLWRNYXTQY-UHFFFAOYSA-NSynonyms
3(4chlorophenyl)2(methoxymethyl)7(2(thiophen2yl)ethyl)pyrazolo(51c)pyrido(43e)(124)triazin6(7H)one
COCC1=NN2C3=C(C(=O)N(C=C3)CCC4=CC=CS4)N=NC2=C1C5=CC=C(C=C5)Cl
InChI=1SC22H18ClN5O2Sc130131719(144615(23)7514)2125242018(28(21)2617)91127(22(20)29)1081632123116h2791112H81013H21H3
MFCD15197332
ZINC000040396225
ZINC40396225
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