Vitas-M small molecule compound
6,6-dimethyl-9-(1-methyl-1H-pyrazol-5-yl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STL400034
SMILES CSc1nn2c(n1)NC1=C(C2c2ccnn2C)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 C16H20N6OS MW 344.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N6OS/c1-16(2)7-9-12(11(23)8-16)13(10-5-6-17-21(10)3)22-14(18-9)19-15(20-22)24-4/h5-6,13H,7-8H2,1-4H3,(H,18,19,20)InChIKey
HTJYUJPMKLFTPQ-UHFFFAOYSA-NSynonyms
1005703-40-11005703401
66dimethyl9(1methyl1Hpyrazol5yl)2(methylsulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
66dimethyl9(2methylpyrazol3yl)2methylsulfanyl1579tetrahydro(124)triazolo(51b)quinazolin8one
CC1(CC2=C(C(N3C(=N2)N=C(N3)SC)C4=CC=NN4C)C(=O)C1)C
InChI=1SC16H20N6OSc116(2)7912(11(23)816)13(10561721(10)3)2214(189)1915(2022)244h5613H78H214H3(H181920)
MFCD05667797
ZINC000017071887
ZINC000017071888
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