Vitas-M small molecule compound

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

Catalog ID
STK230407
SMILES CCn1c(SCC(=O)NC2CCCC2)nnc1C(NC(=O)c1ccc(cc1)Cl)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 C20H26ClN5O2S MW 435.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26ClN5O2S/c1-3-26-18(13(2)22-19(28)14-8-10-15(21)11-9-14)24-25-20(26)29-12-17(27)23-16-6-4-5-7-16/h8-11,13,16H,3-7,12H2,1-2H3,(H,22,28)(H,23,27)
InChIKey
OIZFKPGLCKYTGP-UHFFFAOYSA-N
Synonyms

4CHLORON(1(5((2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4CHLORON(1(5(2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2CCCC2)C(C)NC(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H26ClN5O2Sc132618(13(2)2219(28)1481015(21)11914)242520(26)291217(27)2316645716h8111316H3712H212H3(H2228)(H2327)
MFCD07790456
ZINC000009263731
ZINC000009263732

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Available files

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