Vitas-M small molecule compound
2-[(5-{2-[(3,5-dimethylphenyl)amino]-2-oxoethyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
Catalog ID
STK297271
SMILES CCc1nnc(s1)NC(=O)CSc1nnc(n1CC)CC(=O)Nc1cc(C)cc(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 C20H25N7O2S2 MW 459.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N7O2S2/c1-5-18-24-25-19(31-18)22-17(29)11-30-20-26-23-15(27(20)6-2)10-16(28)21-14-8-12(3)7-13(4)9-14/h7-9H,5-6,10-11H2,1-4H3,(H,21,28)(H,22,25,29)InChIKey
NXRUZIPEVSASKW-UHFFFAOYSA-NSynonyms
2((5(2((35DIMETHYLPHENYL)AMINO)2OXOETHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(5ETHYL134THIADIAZOL2YL)ACETAMIDE
CCC1=NN=C(S1)NC(=O)CSC2=NN=C(N2CC)CC(=O)NC3=CC(=CC(=C3)C)C
InChI=1SC20H25N7O2S2c1518242519(3118)2217(29)113020262315(27(20)62)1016(28)2114812(3)713(4)914h79H561011H214H3(H2128)(H222529)
MFCD09960861
N(35DIMETHYLPHENYL)2(4ETHYL5((5ETHYL(134)THIADIAZOL2YLCARBAMOYL)METHYLSULFANYL)4H(124)TRIAZOL3YL)ACETAMIDE
N(35dimethylphenyl)2(4ethyl5(2((5ethyl134thiadiazol2yl)amino)2oxoethyl)sulfanyl124triazol3yl)acetamide
ZINC000013956105
ZINC13956105
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