Vitas-M small molecule compound
9-(4-methylphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK217440
SMILES CSc1nc2n(n1)C(c1ccc(cc1)C)C1=C(N2)CCCC1=O
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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 C17H18N4OS MW 326.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4OS/c1-10-6-8-11(9-7-10)15-14-12(4-3-5-13(14)22)18-16-19-17(23-2)20-21(15)16/h6-9,15H,3-5H2,1-2H3,(H,18,19,20)InChIKey
ILJYFFOTKAZXKZ-UHFFFAOYSA-NSynonyms
727395-09-72(methylthio)9(ptolyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
727395097
9(4methylphenyl)2(methylsulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(4methylphenyl)2methylsulfanyl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
CC1=CC=C(C=C1)C2C3=C(CCCC3=O)N=C4N2NC(=N4)SC
InChI=1SC17H18N4OSc1106811(9710)151412(43513(14)22)18161917(232)2021(15)16h6915H35H212H3(H181920)
MFCD06192987
ZINC000004436045
ZINC000004436048
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