Vitas-M small molecule compound
2-{[4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Catalog ID
STL144834
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1N)c1[nH]nc(c1)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 C15H16N6O2S MW 344.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N6O2S/c1-9-7-12(18-17-9)14-19-20-15(21(14)16)24-8-13(22)10-3-5-11(23-2)6-4-10/h3-7H,8,16H2,1-2H3,(H,17,18)InChIKey
VPMPUXZBWIAHNF-UHFFFAOYSA-NSynonyms
1045864-23-01045864230
2((4amino5(3methyl1Hpyrazol5yl)4H124triazol3yl)sulfanyl)1(4methoxyphenyl)ethanone
2((4amino5(3methyl1Hpyrazol5yl)4H124triazol3yl)thio)1(4methoxyphenyl)ethanone
2((4AMINO5(5METHYL1HPYRAZOL3YL)124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
2(4AMINO5(3METHYLPYRAZOL5YL)(124TRIAZOL3YLTHIO))1(4METHOXYPHENYL)ETHAN1ONE
CC1=CC(=NN1)C2=NN=C(N2N)SCC(=O)C3=CC=C(C=C3)OC
COc1ccc(cc1)C(=O)CSc1nnc(n1N)c1(nH)nc(c1)C
InChI=1SC15H16N6O2Sc19712(18179)14192015(21(14)16)24813(22)103511(232)6410h37H816H212H3(H1718)
MFCD06771975
ZINC000009374640
ZINC09374640
ZINC9374640
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