Vitas-M small molecule compound

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

Catalog ID
STK443205
SMILES CCCn1c(SCC(=O)Nc2sccc2C#N)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 C13H15N5OS2 MW 321.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N5OS2/c1-3-5-18-9(2)16-17-13(18)21-8-11(19)15-12-10(7-14)4-6-20-12/h4,6H,3,5,8H2,1-2H3,(H,15,19)
InChIKey
BPVFNIVOGKPFRQ-UHFFFAOYSA-N
Synonyms

CCCN1C(=NN=C1SCC(=O)NC2=C(C=CS2)C#N)C
InChI=1SC13H15N5OS2c135189(2)161713(18)21811(19)151210(714)462012h46H358H212H3(H1519)
MFCD04054704
N(3CYANO(2THIENYL))2(5METHYL4PROPYL(124TRIAZOL3YLTHIO))ACETAMIDE
N(3cyanothiophen2yl)2((5methyl4propyl124triazol3yl)sulfanyl)acetamide
N(3cyanothiophen2yl)2((5methyl4propyl4H124triazol3yl)sulfanyl)acetamide
ZINC000006400233
ZINC06400233
ZINC6400233

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Available files

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