Vitas-M small molecule compound
2-{[4-ethyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Catalog ID
STK279410
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)F)nnc1c1ccc2c(c1)CCCC2
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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 C22H23FN4OS MW 410.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN4OS/c1-2-27-21(17-8-7-15-5-3-4-6-16(15)13-17)25-26-22(27)29-14-20(28)24-19-11-9-18(23)10-12-19/h7-13H,2-6,14H2,1H3,(H,24,28)InChIKey
DHTHHEMCLMDVOR-UHFFFAOYSA-NSynonyms
2((4ethyl5(5678tetrahydronaphthalen2yl)124triazol3yl)sulfanyl)N(4fluorophenyl)acetamide
2((4ethyl5(5678tetrahydronaphthalen2yl)4H124triazol3yl)sulfanyl)N(4fluorophenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)F)C3=CC4=C(CCCC4)C=C3
InChI=1SC22H23FN4OSc122721(178715534616(15)1317)252622(27)291420(28)241911918(23)101219h713H2614H21H3(H2428)
MFCD09269848
ZINC000009193345
ZINC09193345
ZINC9193345
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