Vitas-M small molecule compound
9-(1,3-dimethyl-1H-pyrazol-4-yl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STL394214
SMILES CSc1nn2c(n1)NC1=C(C2c2cn(nc2C)C)C(=O)CCC1
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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 C15H18N6OS MW 330.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N6OS/c1-8-9(7-20(2)18-8)13-12-10(5-4-6-11(12)22)16-14-17-15(23-3)19-21(13)14/h7,13H,4-6H2,1-3H3,(H,16,17,19)InChIKey
MDTGNJAHFUMBRW-UHFFFAOYSA-NSynonyms
1005651-31-91005651319
9(13dimethyl1Hpyrazol4yl)2(methylsulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(13dimethylpyrazol4yl)2methylsulfanyl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
CC1=NN(C=C1C2C3=C(CCCC3=O)N=C4N2NC(=N4)SC)C
InChI=1SC15H18N6OSc189(720(2)188)131210(54611(12)22)16141715(233)1921(13)14h713H46H213H3(H161719)
MFCD04139988
ZINC000006921557
ZINC000006921593
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