Vitas-M small molecule compound
methyl {[4-amino-5-(3-phenyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Catalog ID
STL144833
SMILES COC(=O)CSc1nnc(n1N)c1[nH]nc(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 C14H14N6O2S MW 330.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N6O2S/c1-22-12(21)8-23-14-19-18-13(20(14)15)11-7-10(16-17-11)9-5-3-2-4-6-9/h2-7H,8,15H2,1H3,(H,16,17)InChIKey
LEALKRLHWZYAEP-UHFFFAOYSA-NSynonyms
879463-52-2879463522
COC(=O)CSC1=NN=C(N1N)C2=CC(=NN2)C3=CC=CC=C3
COC(=O)CSc1nnc(n1N)c1(nH)nc(c1)c1ccccc1
InChI=1SC14H14N6O2Sc12212(21)82314191813(20(14)15)11710(161711)9532469h27H815H21H3(H1617)
METHYL((4AMINO5(3PHENYL1HPYRAZOL5YL)4H124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2((4AMINO5(3PHENYL1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)ACETATE
methyl2((4amino5(3phenyl1Hpyrazol5yl)4H124triazol3yl)thio)acetate
METHYL2(4AMINO5(3PHENYLPYRAZOL5YL)124TRIAZOL3YLTHIO)ACETATE
MFCD06781599
ZINC000009320682
ZINC09320682
ZINC9320682
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