Vitas-M small molecule compound
2-[5-({2-[(5-cyclohexyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STK230655
SMILES O=C(Nc1nnc(s1)C1CCCCC1)CSc1nnc(n1C)CC(=O)Nc1ccc(c(c1)C)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 C23H29N7O2S2 MW 499.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N7O2S2/c1-14-9-10-17(11-15(14)2)24-19(31)12-18-26-29-23(30(18)3)33-13-20(32)25-22-28-27-21(34-22)16-7-5-4-6-8-16/h9-11,16H,4-8,12-13H2,1-3H3,(H,24,31)(H,25,28,32)InChIKey
WFZRDLSGANOGLW-UHFFFAOYSA-NSynonyms
2(5((2((5cyclohexyl134thiadiazol2yl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)N(34dimethylphenyl)acetamide
2(5(2((5CYCLOHEXYL134THIADIAZOL2YL)AMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(34DIMETHYLPHENYL)ACETAMIDE
CC1=C(C=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC(=O)NC3=NN=C(S3)C4CCCCC4)C
InChI=1SC23H29N7O2S2c11491017(1115(14)2)2419(31)1218262923(30(18)3)331320(32)2522282721(3422)167546816h91116H481213H213H3(H2431)(H252832)
MFCD07790741
ZINC000009289817
ZINC09289817
ZINC9289817
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