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-(4-methylphenyl)acetamide
Catalog ID
STK230651
SMILES O=C(Nc1nnc(s1)C1CCCCC1)CSc1nnc(n1C)CC(=O)Nc1ccc(cc1)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 C22H27N7O2S2 MW 485.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N7O2S2/c1-14-8-10-16(11-9-14)23-18(30)12-17-25-28-22(29(17)2)32-13-19(31)24-21-27-26-20(33-21)15-6-4-3-5-7-15/h8-11,15H,3-7,12-13H2,1-2H3,(H,23,30)(H,24,27,31)InChIKey
GWWMGQPBDYCZTM-UHFFFAOYSA-NSynonyms
2(5((2((5cyclohexyl134thiadiazol2yl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)N(4methylphenyl)acetamide
2(5(2((5CYCLOHEXYL134THIADIAZOL2YL)AMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(4METHYLPHENYL)ACETAMIDE
CC1=CC=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC(=O)NC3=NN=C(S3)C4CCCCC4
InChI=1SC22H27N7O2S2c11481016(11914)2318(30)1217252822(29(17)2)321319(31)2421272620(3321)156435715h81115H371213H212H3(H2330)(H242731)
MFCD07790728
ZINC000009289812
ZINC09289812
ZINC9289812
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