Vitas-M small molecule compound

1-(azepan-1-yl)-2-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-ylsulfanyl)ethanone

Catalog ID
STK877883
SMILES O=C(N1CCCCCC1)CSc1sc2n(n1)cnn2

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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 C11H15N5OS2 MW 297.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H15N5OS2/c17-9(15-5-3-1-2-4-6-15)7-18-11-14-16-8-12-13-10(16)19-11/h8H,1-7H2
InChIKey
YKDFQTKAMDPRHI-UHFFFAOYSA-N
Synonyms
876878-55-6
1(azepan1yl)2((124)triazolo(34b)(134)thiadiazol6ylsulfanyl)ethanone
1AZEPAN1YL2((124)TRIAZOLO(34B)(134)THIADIAZOL6YLSULFANYL)ETHANONE
2((124)triazolo(34b)(134)thiadiazol6ylthio)1(azepan1yl)ethanone
876878556
C1CCCN(CC1)C(=O)CSC2=NN3C=NN=C3S2
InChI=1SC11H15N5OS2c179(1553124615)7181114168121310(16)1911h8H17H2
MFCD06612918
ZINC000002360181
ZINC02360181
ZINC2360181

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Available files

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