Vitas-M small molecule compound
2-({5-[4-(acetylamino)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
Catalog ID
STK122338
SMILES O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1C)c1ccc(cc1)NC(=O)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 C22H25N5O2S MW 423.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O2S/c1-13-10-14(2)20(15(3)11-13)24-19(29)12-30-22-26-25-21(27(22)5)17-6-8-18(9-7-17)23-16(4)28/h6-11H,12H2,1-5H3,(H,23,28)(H,24,29)InChIKey
QKMKTRGPTSWCMN-UHFFFAOYSA-NSynonyms
2((5(4(ACETYLAMINO)PHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
2((5(4ACETAMIDOPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)NC(=O)C)C
InChI=1SC22H25N5O2Sc1131014(2)20(15(3)1113)2419(29)123022262521(27(22)5)176818(9717)2316(4)28h611H12H215H3(H2328)(H2429)
MFCD03876672
ZINC000004698884
ZINC04698884
ZINC4698884
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