Vitas-M small molecule compound

N-(furan-2-ylmethyl)-2-[(5-methyl-4-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide

Catalog ID
STK408544
SMILES CCCn1c(SCC(=O)NCc2ccco2)nnc1C

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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 C13H18N4O2S MW 294.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O2S/c1-3-6-17-10(2)15-16-13(17)20-9-12(18)14-8-11-5-4-7-19-11/h4-5,7H,3,6,8-9H2,1-2H3,(H,14,18)
InChIKey
CXYPQHJVQODSHU-UHFFFAOYSA-N
Synonyms

CCCN1C(=NN=C1SCC(=O)NCC2=CC=CO2)C
InChI=1SC13H18N4O2Sc1361710(2)151613(17)20912(18)148115471911h457H3689H212H3(H1418)
MFCD04056106
N(2FURYLMETHYL)2(5METHYL4PROPYL(124TRIAZOL3YLTHIO))ACETAMIDE
N(furan2ylmethyl)2((5methyl4propyl124triazol3yl)sulfanyl)acetamide
N(furan2ylmethyl)2((5methyl4propyl4H124triazol3yl)sulfanyl)acetamide
ZINC000006400159
ZINC06400159
ZINC6400159

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Available files

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