Vitas-M small molecule compound
2-{[4-cyclohexyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Catalog ID
STK278536
SMILES COc1ccccc1c1nnc(n1C1CCCCC1)SCC(=O)Nc1scc(n1)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 C21H25N5O2S2 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2S2/c1-14-12-29-20(22-14)23-18(27)13-30-21-25-24-19(16-10-6-7-11-17(16)28-2)26(21)15-8-4-3-5-9-15/h6-7,10-12,15H,3-5,8-9,13H2,1-2H3,(H,22,23,27)InChIKey
XTLQFPNPJLCGQD-UHFFFAOYSA-NSynonyms
2((4cyclohexyl5(2methoxyphenyl)124triazol3yl)sulfanyl)N(4methyl13thiazol2yl)acetamide
2((4cyclohexyl5(2methoxyphenyl)4H124triazol3yl)sulfanyl)N(4methyl13thiazol2yl)acetamide
CC1=CSC(=N1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4OC
InChI=1SC21H25N5O2S2c114122920(2214)2318(27)133021252419(1610671117(16)282)26(21)158435915h67101215H358913H212H3(H222327)
MFCD09269333
ZINC000009095727
ZINC09095727
ZINC9095727
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