Vitas-M small molecule compound

9-(3,5-difluorophenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one

Catalog ID
STK232157
SMILES CSc1nn2c(n1)NC1=C(C2c2cc(F)cc(c2)F)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 C16H14F2N4OS MW 348.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F2N4OS/c1-24-16-20-15-19-11-3-2-4-12(23)13(11)14(22(15)21-16)8-5-9(17)7-10(18)6-8/h5-7,14H,2-4H2,1H3,(H,19,20,21)
InChIKey
DLZSQWHOXSWOHZ-UHFFFAOYSA-N
Synonyms
777871-09-7
777871097
9(35difluorophenyl)2(methylsulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(35difluorophenyl)2(methylthio)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(35difluorophenyl)2methylsulfanyl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
CSC1=NC2=NC3=C(C(N2N1)C4=CC(=CC(=C4)F)F)C(=O)CCC3
InChI=1SC16H14F2N4OSc124162015191132412(23)13(11)14(22(15)2116)859(17)710(18)68h5714H24H21H3(H192021)
MFCD06593698
ZINC000004488265
ZINC000004488266

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Available files

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