Vitas-M small molecule compound
2-[(4-ethyl-5-{2-[(2-methylphenyl)amino]-2-oxoethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide
Catalog ID
STK221878
SMILES CCn1c(SCC(=O)NC23CC4CC(C3)CC(C2)C4)nnc1CC(=O)Nc1ccccc1C
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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 C25H33N5O2S MW 467.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N5O2S/c1-3-30-21(11-22(31)26-20-7-5-4-6-16(20)2)28-29-24(30)33-15-23(32)27-25-12-17-8-18(13-25)10-19(9-17)14-25/h4-7,17-19H,3,8-15H2,1-2H3,(H,26,31)(H,27,32)InChIKey
ASWMIUPJQSIMQG-UHFFFAOYSA-NSynonyms
2((4ethyl5(2((2methylphenyl)amino)2oxoethyl)4H124triazol3yl)sulfanyl)N(tricyclo(3311~37~)dec1yl)acetamide
2(5(2(1ADAMANTYLAMINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)N(2METHYLPHENYL)ACETAMIDE
2(5(ADAMANTAN1YLCARBAMOYLMETHYLSULFANYL)4ETHYL4H(124)TRIAZOL3YL)NOTOLYLACETAMIDE
CCN1C(=NN=C1SCC(=O)NC23CC4CC(C2)CC(C4)C3)CC(=O)NC5=CC=CC=C5C
InChI=1SC25H33N5O2Sc133021(1122(31)2620754616(20)2)282924(30)331523(32)27251217818(1325)1019(917)1425h471719H3815H212H3(H2631)(H2732)
MFCD07399372
ZINC000009302447
ZINC09302447
ZINC9302447
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