Vitas-M small molecule compound
9-(pyridin-2-yl)-2-[(pyridin-3-ylmethyl)sulfanyl]-6-(thiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK335701
SMILES O=C1CC(CC2=C1C(c1ccccn1)n1c(N2)nc(n1)SCc1cccnc1)c1cccs1
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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 C24H20N6OS2 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N6OS2/c31-19-12-16(20-7-4-10-32-20)11-18-21(19)22(17-6-1-2-9-26-17)30-23(27-18)28-24(29-30)33-14-15-5-3-8-25-13-15/h1-10,13,16,22H,11-12,14H2,(H,27,28,29)InChIKey
IFBNHMZDJHEYSW-UHFFFAOYSA-NSynonyms
9(pyridin2yl)2((pyridin3ylmethyl)sulfanyl)6(thiophen2yl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9pyridin2yl2(pyridin3ylmethylsulfanyl)6thiophen2yl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
C1C(CC(=O)C2=C1N=C3N=C(NN3C2C4=CC=CC=N4)SCC5=CN=CC=C5)C6=CC=CS6
InChI=1SC24H20N6OS2c31191216(2074103220)111821(19)22(1761292617)3023(2718)2824(2930)331415538251315h110131622H111214H2(H272829)
MFCD09964191
ZINC000018199830
ZINC000018199836
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