Vitas-M small molecule compound
2-{[5-(4-chloro-1,3-dimethyl-1H-pyrazol-5-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-chloro-4-fluorophenyl)acetamide
Catalog ID
STK302382
SMILES CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)F)nnc1c1n(C)nc(c1Cl)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 C17H17Cl2FN6OS MW 443.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17Cl2FN6OS/c1-4-26-16(15-14(19)9(2)24-25(15)3)22-23-17(26)28-8-13(27)21-10-5-6-12(20)11(18)7-10/h5-7H,4,8H2,1-3H3,(H,21,27)InChIKey
CSJOUHJFCZGPKL-UHFFFAOYSA-NSynonyms
512823-81-32((5(4chloro13dimethyl1Hpyrazol5yl)4ethyl4H124triazol3yl)sulfanyl)N(3chloro4fluorophenyl)acetamide
2((5(4CHLORO25DIMETHYLPYRAZOL3YL)4ETHYL124TRIAZOL3YL)SULFANYL)N(3CHLORO4FLUOROPHENYL)ACETAMIDE
512823813
CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)F)Cl)C3=C(C(=NN3C)C)Cl
InChI=1SC17H17Cl2FN6OSc142616(1514(19)9(2)2425(15)3)222317(26)28813(27)21105612(20)11(18)710h57H48H213H3(H2127)
MFCD03468438
ZINC000002735436
ZINC02735436
ZINC2735436
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