Vitas-M small molecule compound

N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2-(pyrimidin-2-ylsulfanyl)acetamide

Catalog ID
STK474741
SMILES N#Cc1c(NC(=O)CSc2ncccn2)sc2c1CCCCCC2

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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 C17H18N4OS2 MW 358.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4OS2/c18-10-13-12-6-3-1-2-4-7-14(12)24-16(13)21-15(22)11-23-17-19-8-5-9-20-17/h5,8-9H,1-4,6-7,11H2,(H,21,22)
InChIKey
SBDMIBIOJVPRMG-UHFFFAOYSA-N
Synonyms

C1CCCC2=C(CC1)C(=C(S2)NC(=O)CSC3=NC=CC=N3)C#N
InChI=1SC17H18N4OS2c1810131263124714(12)2416(13)2115(22)112317198592017h589H146711H2(H2122)
MFCD03771143
N(3cyano456789hexahydrocycloocta(b)thiophen2yl)2(pyrimidin2ylsulfanyl)acetamide
N(3cyano456789hexahydrocycloocta(b)thiophen2yl)2pyrimidin2ylsulfanylacetamide
ZINC000006741332
ZINC06741332
ZINC6741332

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Available files

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