Vitas-M small molecule compound

N-(4-chlorophenyl)-2-[(5-ethyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide

Catalog ID
STK400858
SMILES CCc1nnc(n1C)SCC(=O)Nc1ccc(cc1)Cl

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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 C13H15ClN4OS MW 310.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15ClN4OS/c1-3-11-16-17-13(18(11)2)20-8-12(19)15-10-6-4-9(14)5-7-10/h4-7H,3,8H2,1-2H3,(H,15,19)
InChIKey
XDOPNRGEZGECOJ-UHFFFAOYSA-N
Synonyms

CCC1=NN=C(N1C)SCC(=O)NC2=CC=C(C=C2)Cl
InChI=1SC13H15ClN4OSc1311161713(18(11)2)20812(19)1510649(14)5710h47H38H212H3(H1519)
MFCD05082175
N(4CHLOROPHENYL)2((5ETHYL4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4chlorophenyl)2((5ethyl4methyl4H124triazol3yl)sulfanyl)acetamide
N(4CHLOROPHENYL)2(5ETHYL4METHYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000006730285
ZINC06730285
ZINC6730285

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Available files

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