Vitas-M small molecule compound
9-(3-methoxyphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK232079
SMILES COc1cccc(c1)C1C2=C(CCCC2=O)Nc2n1nc(n2)SC
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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 C17H18N4O2S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O2S/c1-23-11-6-3-5-10(9-11)15-14-12(7-4-8-13(14)22)18-16-19-17(24-2)20-21(15)16/h3,5-6,9,15H,4,7-8H2,1-2H3,(H,18,19,20)InChIKey
AJKQWKOMCCNNHX-UHFFFAOYSA-NSynonyms
727395-24-6727395246
9(3methoxyphenyl)2(methylsulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(3methoxyphenyl)2(methylthio)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(3methoxyphenyl)2methylsulfanyl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
COC1=CC=CC(=C1)C2C3=C(CCCC3=O)N=C4N2NC(=N4)SC
InChI=1SC17H18N4O2Sc1231163510(911)151412(74813(14)22)18161917(242)2021(15)16h356915H478H212H3(H181920)
MFCD06193001
ZINC000004436104
ZINC000004436105
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