Vitas-M small molecule compound
9-(2-fluorophenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK508629
SMILES CSc1nn2c(n1)NC1=C(C2c2ccccc2F)C(=O)CCC1
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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 C16H15FN4OS MW 330.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15FN4OS/c1-23-16-19-15-18-11-7-4-8-12(22)13(11)14(21(15)20-16)9-5-2-3-6-10(9)17/h2-3,5-6,14H,4,7-8H2,1H3,(H,18,19,20)InChIKey
KNBHCVQUCDMXNW-UHFFFAOYSA-NSynonyms
9(2fluorophenyl)2(methylsulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(2fluorophenyl)2methylsulfanyl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
CSC1=NC2=NC3=C(C(N2N1)C4=CC=CC=C4F)C(=O)CCC3
InChI=1SC16H15FN4OSc123161915181174812(22)13(11)14(21(15)2016)9523610(9)17h235614H478H21H3(H181920)
MFCD06193006
ZINC000006677823
ZINC000006677824
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