Vitas-M small molecule compound
2-{[5-(3-chloro-4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide
Catalog ID
STK202420
SMILES C=CCn1c(SCC(=O)NC2CCCCC2)nnc1c1ccc(c(c1)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 C20H25ClN4OS MW 404.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN4OS/c1-3-11-25-19(15-10-9-14(2)17(21)12-15)23-24-20(25)27-13-18(26)22-16-7-5-4-6-8-16/h3,9-10,12,16H,1,4-8,11,13H2,2H3,(H,22,26)InChIKey
BVKMLLNUGIHMAJ-UHFFFAOYSA-NSynonyms
2((5(3CHLORO4METHYLPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)NCYCLOHEXYLACETAMIDE
2((5(3CHLORO4METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)NCYCLOHEXYLACETAMIDE
CC1=C(C=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3CCCCC3)Cl
InChI=1SC20H25ClN4OSc13112519(1510914(2)17(21)1215)232420(25)271318(26)22167546816h39101216H1481113H22H3(H2226)
MFCD04384932
ZINC000001122641
ZINC01122641
ZINC1122641
Check stock
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Check stock on Vitas-MAvailable files
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