Vitas-M small molecule compound
ethyl 4-[({[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK587361
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(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 C17H19N7O3S MW 401.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N7O3S/c1-3-27-16(26)11-4-6-12(7-5-11)19-14(25)9-28-17-23-22-15(24(17)18)13-8-10(2)20-21-13/h4-8H,3,9,18H2,1-2H3,(H,19,25)(H,20,21)InChIKey
TYHZFZCWLJBTAR-UHFFFAOYSA-NSynonyms
879471-66-6879471666
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=NNC(=C3)C
CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1(nH)nc(c1)C
CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n(nH)c(c1)C
ethyl4((((4amino5(5methyl1Hpyrazol3yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2((4AMINO5(5METHYL1HPYRAZOL3YL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ethyl4(2((4amino5(3methyl1Hpyrazol5yl)4H124triazol3yl)thio)acetamido)benzoate
ETHYL4(2(4AMINO5(3METHYLPYRAZOL5YL)124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
InChI=1SC17H19N7O3Sc132716(26)114612(7511)1914(25)92817232215(24(17)18)13810(2)202113h48H3918H212H3(H1925)(H2021)
MFCD07209153
ZINC000009453053
ZINC09453053
ZINC9453053
Check stock
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Check stock on Vitas-MAvailable files
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