Vitas-M small molecule compound
2-{[4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-chloro-4,6-dimethylphenyl)acetamide
Catalog ID
STL144837
SMILES O=C(Nc1c(C)cc(cc1Cl)C)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 C16H18ClN7OS MW 391.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN7OS/c1-8-4-9(2)14(11(17)5-8)19-13(25)7-26-16-23-22-15(24(16)18)12-6-10(3)20-21-12/h4-6H,7,18H2,1-3H3,(H,19,25)(H,20,21)InChIKey
WDQATESJYISMAX-UHFFFAOYSA-NSynonyms
1039012-20-81039012208
2((4amino5(3methyl1Hpyrazol5yl)4H124triazol3yl)sulfanyl)N(2chloro46dimethylphenyl)acetamide
2((4amino5(3methyl1Hpyrazol5yl)4H124triazol3yl)thio)N(2chloro46dimethylphenyl)acetamide
2((4AMINO5(5METHYL1HPYRAZOL3YL)124TRIAZOL3YL)SULFANYL)N(2CHLORO46DIMETHYLPHENYL)ACETAMIDE
2(4AMINO5(3METHYLPYRAZOL5YL)(124TRIAZOL3YLTHIO))N(2CHLORO46DIMETHYLPHENYL)ACETAMIDE
CC1=CC(=C(C(=C1)Cl)NC(=O)CSC2=NN=C(N2N)C3=NNC(=C3)C)C
InChI=1SC16H18ClN7OSc1849(2)14(11(17)58)1913(25)72616232215(24(16)18)12610(3)202112h46H718H213H3(H1925)(H2021)
MFCD06782619
O=C(Nc1c(C)cc(cc1Cl)C)CSc1nnc(n1N)c1(nH)nc(c1)C
ZINC000009374565
ZINC09374565
ZINC9374565
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