Vitas-M small molecule compound
2-ethyl-3-(4-fluorophenyl)-7-[2-(1H-imidazol-5-yl)ethyl]pyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one
Catalog ID
STL198062
SMILES CCc1nn2c(c1c1ccc(cc1)F)nnc1c2ccn(c1=O)CCc1cnc[nH]1
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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 C21H18FN7O MW 403.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN7O/c1-2-16-18(13-3-5-14(22)6-4-13)20-26-25-19-17(29(20)27-16)8-10-28(21(19)30)9-7-15-11-23-12-24-15/h3-6,8,10-12H,2,7,9H2,1H3,(H,23,24)InChIKey
XSGYNUPRQFTQCG-UHFFFAOYSA-NSynonyms
2ethyl3(4fluorophenyl)7(2(1Himidazol5yl)ethyl)pyrazolo(51c)pyrido(43e)(124)triazin6(7H)one
CCC1=NN2C3=C(C(=O)N(C=C3)CCC4=CN=CN4)N=NC2=C1C5=CC=C(C=C5)F
CCc1nn2c(c1c1ccc(cc1)F)nnc1c2ccn(c1=O)CCc1cnc(nH)1
InChI=1SC21H18FN7Oc121618(133514(22)6413)2026251917(29(20)2716)81028(21(19)30)97151123122415h3681012H279H21H3(H2324)
MFCD15196859
ZINC000040391754
ZINC40391754
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