Vitas-M small molecule compound
9-[4-(methylsulfanyl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK263159
SMILES CSc1ccc(cc1)C1C2=C(CCCC2=O)Nc2n1ncn2
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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 C16H16N4OS MW 312.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4OS/c1-22-11-7-5-10(6-8-11)15-14-12(3-2-4-13(14)21)19-16-17-9-18-20(15)16/h5-9,15H,2-4H2,1H3,(H,17,18,19)InChIKey
IINZFOWWKCYDFS-UHFFFAOYSA-NSynonyms
9(4(methylsulfanyl)phenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(4methylsulfanylphenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
CSC1=CC=C(C=C1)C2C3=C(CCCC3=O)N=C4N2NC=N4
InChI=1SC16H16N4OSc122117510(6811)151412(32413(14)21)19161791820(15)16h5915H24H21H3(H171819)
MFCD05028312
ZINC000000222566
ZINC000000222567
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