Vitas-M small molecule compound

N-[1-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]-2-fluorobenzamide

Catalog ID
STK218591
SMILES CCn1c(SCC(=O)NC2CCCCC2)nnc1C(NC(=O)c1ccccc1F)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 C21H28FN5O2S MW 433.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28FN5O2S/c1-3-27-19(14(2)23-20(29)16-11-7-8-12-17(16)22)25-26-21(27)30-13-18(28)24-15-9-5-4-6-10-15/h7-8,11-12,14-15H,3-6,9-10,13H2,1-2H3,(H,23,29)(H,24,28)
InChIKey
UDOYNUKICXNSKZ-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)NC2CCCCC2)C(C)NC(=O)C3=CC=CC=C3F
InChI=1SC21H28FN5O2Sc132719(14(2)2320(29)1611781217(16)22)252621(27)301318(28)241595461015h7811121415H3691013H212H3(H2329)(H2428)
MFCD07398851
N(1(5((2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(1(5(2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
N(1(5CYCLOHEXYLCARBAMOYLMETHYLSULFANYL4ETHYL4H(124)TRIAZOL3YL)ETHYL)2FLUOROBENZAMIDE
NCYCLOHEXYL2(4ETHYL5(((2FLUOROPHENYL)CARBONYLAMINO)ETHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009262955
ZINC000009262958

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Available files

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