Vitas-M small molecule compound
9-(1-ethyl-1H-pyrazol-5-yl)-6,6-dimethyl-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STL403052
SMILES CSc1nn2c(n1)NC1=C(C2c2ccnn2CC)C(=O)CC(C1)(C)C
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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 C17H22N6OS MW 358.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6OS/c1-5-22-11(6-7-18-22)14-13-10(8-17(2,3)9-12(13)24)19-15-20-16(25-4)21-23(14)15/h6-7,14H,5,8-9H2,1-4H3,(H,19,20,21)InChIKey
MZCYHIAOFTVAMH-UHFFFAOYSA-NSynonyms
1006349-24-11006349241
9(1ethyl1Hpyrazol5yl)66dimethyl2(methylsulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(2ethylpyrazol3yl)66dimethyl2methylsulfanyl1579tetrahydro(124)triazolo(51b)quinazolin8one
CCN1C(=CC=N1)C2C3=C(CC(CC3=O)(C)C)N=C4N2NC(=N4)SC
InChI=1SC17H22N6OSc152211(671822)141310(817(23)912(13)24)19152016(254)2123(14)15h6714H589H214H3(H192021)
MFCD08558544
ZINC000020607197
ZINC000020607199
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