Vitas-M small molecule compound

2-{[5-(2,4-dichlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide

Catalog ID
STK140266
SMILES O=C(CSc1nnc(n1C)c1ccc(cc1Cl)Cl)NCCc1ccccc1

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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 C19H18Cl2N4OS MW 421.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18Cl2N4OS/c1-25-18(15-8-7-14(20)11-16(15)21)23-24-19(25)27-12-17(26)22-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3,(H,22,26)
InChIKey
XBTZNTMKZRUMSL-UHFFFAOYSA-N
Synonyms

2((5(24dichlorophenyl)4methyl124triazol3yl)sulfanyl)N(2phenylethyl)acetamide
2((5(24DICHLOROPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)NPHENETHYLACETAMIDE
2((5(24DICHLOROPHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(2PHENYLETHYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NCCC2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl
InChI=1SC19H18Cl2N4OSc12518(158714(20)1116(15)21)232419(25)271217(26)22109135324613h2811H91012H21H3(H2226)
MFCD03721747
ZINC000002830699
ZINC02830699
ZINC2830699

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.