Vitas-M small molecule compound
3-(4-fluorophenyl)-2-methyl-7-[2-(thiophen-2-yl)ethyl]pyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one
Catalog ID
STL121766
SMILES Fc1ccc(cc1)c1c(C)nn2c1nnc1c2ccn(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 C21H16FN5OS MW 405.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16FN5OS/c1-13-18(14-4-6-15(22)7-5-14)20-24-23-19-17(27(20)25-13)9-11-26(21(19)28)10-8-16-3-2-12-29-16/h2-7,9,11-12H,8,10H2,1H3InChIKey
PRMAJUFPKKRQGC-UHFFFAOYSA-NSynonyms
3(4fluorophenyl)2methyl7(2(thiophen2yl)ethyl)pyrazolo(51c)pyrido(43e)(124)triazin6(7H)one
CC1=NN2C3=C(C(=O)N(C=C3)CCC4=CC=CS4)N=NC2=C1C5=CC=C(C=C5)F
InChI=1SC21H16FN5OSc11318(144615(22)7514)2024231917(27(20)2513)91126(21(19)28)1081632122916h2791112H810H21H3
MFCD15196957
ZINC000040392070
ZINC40392070
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