Vitas-M small molecule compound

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

Catalog ID
STK119186
SMILES CCc1nnc([nH]1)SCC(=O)Nc1ccccc1C#N

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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 C13H13N5OS MW 287.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N5OS/c1-2-11-16-13(18-17-11)20-8-12(19)15-10-6-4-3-5-9(10)7-14/h3-6H,2,8H2,1H3,(H,15,19)(H,16,17,18)
InChIKey
QSKPCIZHXQPXDT-UHFFFAOYSA-N
Synonyms
354539-52-9
354539529
CCC1=NC(=NN1)SCC(=O)NC2=CC=CC=C2C#N
CCc1nnc((nH)1)SCC(=O)Nc1ccccc1C#N
InChI=1SC13H13N5OSc12111613(181711)20812(19)151064359(10)714h36H28H21H3(H1519)(H161718)
MFCD02056571
N(2CYANOPHENYL)2((5ETHYL1H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2CYANOPHENYL)2((5ETHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000018093952
ZINC18093952

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Available files

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