Vitas-M small molecule compound
1-{[4-amino-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propan-2-one
Catalog ID
STK586854
SMILES CC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1
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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 C14H14N6OS MW 314.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N6OS/c1-9(21)8-22-14-19-18-13(20(14)15)12-7-11(16-17-12)10-5-3-2-4-6-10/h2-7H,8,15H2,1H3,(H,16,17)InChIKey
GLYMNPBFMLQGET-UHFFFAOYSA-NSynonyms
879461-09-31((4AMINO5(3PHENYL1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)PROPAN2ONE
1((4amino5(3phenyl1Hpyrazol5yl)4H124triazol3yl)thio)propan2one
1((4amino5(5phenyl1Hpyrazol3yl)4H124triazol3yl)sulfanyl)propan2one
1(4AMINO5(3PHENYLPYRAZOL5YL)124TRIAZOL3YLTHIO)ACETONE
879461093
CC(=O)CSC1=NN=C(N1N)C2=CC(=NN2)C3=CC=CC=C3
CC(=O)CSc1nnc(n1N)c1(nH)nc(c1)c1ccccc1
CC(=O)CSc1nnc(n1N)c1n(nH)c(c1)c1ccccc1
InChI=1SC14H14N6OSc19(21)82214191813(20(14)15)12711(161712)105324610h27H815H21H3(H1617)
MFCD07211323
ZINC000009320449
ZINC09320449
ZINC9320449
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