Vitas-M small molecule compound
2-(methylsulfanyl)-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK217439
SMILES CSc1nn2c(n1)NC1=C(C2c2ccccc2)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 C16H16N4OS MW 312.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4OS/c1-22-16-18-15-17-11-8-5-9-12(21)13(11)14(20(15)19-16)10-6-3-2-4-7-10/h2-4,6-7,14H,5,8-9H2,1H3,(H,17,18,19)InChIKey
FGWNSAWYOJQWAA-UHFFFAOYSA-NSynonyms
727395-08-62(methylsulfanyl)9phenyl5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2(methylthio)9phenyl5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2methylsulfanyl9phenyl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
727395086
CSC1=NC2=NC3=C(C(N2N1)C4=CC=CC=C4)C(=O)CCC3
InChI=1SC16H16N4OSc122161815171185912(21)13(11)14(20(15)1916)106324710h246714H589H21H3(H171819)
MFCD06192986
ZINC000004436040
ZINC000004436042
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