Vitas-M small molecule compound
2-({5-[(2,6-dimethylphenoxy)methyl]-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide
Catalog ID
STK297326
SMILES CCc1nnc(s1)NC(=O)C(Sc1nnc(n1C(C)C)COc1c(C)cccc1C)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 C21H28N6O2S2 MW 460.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N6O2S2/c1-7-17-24-25-20(31-17)22-19(28)15(6)30-21-26-23-16(27(21)12(2)3)11-29-18-13(4)9-8-10-14(18)5/h8-10,12,15H,7,11H2,1-6H3,(H,22,25,28)InChIKey
XDTIJPQBAGPXPY-UHFFFAOYSA-NSynonyms
2((5((26dimethylphenoxy)methyl)4(propan2yl)4H124triazol3yl)sulfanyl)N(5ethyl134thiadiazol2yl)propanamide
2((5((26dimethylphenoxy)methyl)4propan2yl124triazol3yl)sulfanyl)N(5ethyl134thiadiazol2yl)propanamide
2(5(26DIMETHYLPHENOXYMETHYL)4ISOPROPYL4H(124)TRIAZOL3YLSULFANYL)N(5ETHYL(134)THIADIAZOL2YL)PROPIONAMIDE
CCC1=NN=C(S1)NC(=O)C(C)SC2=NN=C(N2C(C)C)COC3=C(C=CC=C3C)C
InChI=1SC21H28N6O2S2c1717242520(3117)2219(28)15(6)3021262316(27(21)12(2)3)11291813(4)981014(18)5h8101215H711H216H3(H222528)
MFCD09960911
ZINC000013956251
ZINC000013956252
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