Vitas-M small molecule compound
1-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-4-methyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK542408
SMILES C/C(=C/CSc1nnc2n1c1sc3c(c1c(=O)n2C)CCCC3)/Cl
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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 C16H17ClN4OS2 MW 380.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4OS2/c1-9(17)7-8-23-16-19-18-15-20(2)13(22)12-10-5-3-4-6-11(10)24-14(12)21(15)16/h7H,3-6,8H2,1-2H3/b9-7-InChIKey
PZAXOAMSJOKMRW-CLFYSBASSA-NSynonyms
489444-38-4(Z)1((3chlorobut2en1yl)thio)4methyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(((2Z)3chlorobut2en1yl)sulfanyl)4methyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
489444384
CC(=CCSC1=NN=C2N1C3=C(C4=C(S3)CCCC4)C(=O)N2C)Cl
CC(=CCSc1nnc2n1c1sc3c(c1c(=O)n2C)CCCC3)Cl
InChI=1SC16H17ClN4OS2c19(17)78231619181520(2)13(22)1210534611(10)2414(12)21(15)16h7H368H212H3b97
MFCD03297451
ZINC000001301460
ZINC01301460
ZINC1301460
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