Vitas-M small molecule compound
1-{2-[(4-bromobenzyl)sulfanyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethanone
Catalog ID
STL389427
SMILES Brc1ccc(cc1)CSc1nn2c(n1)nc(c(c2C)C(=O)C)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 C16H15BrN4OS MW 391.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN4OS/c1-9-14(11(3)22)10(2)21-15(18-9)19-16(20-21)23-8-12-4-6-13(17)7-5-12/h4-7H,8H2,1-3H3InChIKey
SXYFXHFTQFTDOK-UHFFFAOYSA-NSynonyms
1(2((4bromobenzyl)sulfanyl)57dimethyl(124)triazolo(15a)pyrimidin6yl)ethanone
1(2((4bromophenyl)methylsulfanyl)57dimethyl(124)triazolo(15a)pyrimidin6yl)ethanone
CC1=C(C(=NC2=NC(=NN12)SCC3=CC=C(C=C3)Br)C)C(=O)C
InChI=1SC16H15BrN4OSc1914(11(3)22)10(2)2115(189)1916(2021)238124613(17)7512h47H8H213H3
MFCD28122514
ZINC000095115677
ZINC95115677
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