Vitas-M small molecule compound
6,6-dimethyl-9-(3-methylthiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK232065
SMILES O=C1CC(C)(C)CC2=C1C(n1c(N2)ncn1)c1sccc1C
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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 C16H18N4OS MW 314.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4OS/c1-9-4-5-22-14(9)13-12-10(6-16(2,3)7-11(12)21)19-15-17-8-18-20(13)15/h4-5,8,13H,6-7H2,1-3H3,(H,17,18,19)InChIKey
IGIZMOMXCYQAAX-UHFFFAOYSA-NSynonyms
537003-58-0537003580
66dimethyl9(3methylthiophen2yl)1579tetrahydro(124)triazolo(51b)quinazolin8one
66dimethyl9(3methylthiophen2yl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
CC1=C(SC=C1)C2C3=C(CC(CC3=O)(C)C)N=C4N2NC=N4
InChI=1SC16H18N4OSc19452214(9)131210(616(23)711(12)21)19151781820(13)15h45813H67H213H3(H171819)
MFCD03543161
ZINC000013132184
ZINC000013132186
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