Vitas-M small molecule compound

3-chloro-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)-1-benzothiophene-2-carboxamide

Catalog ID
STK032183
SMILES S=C(NC12CC3CC(C2)CC(C1)C3)NC(=O)c1sc2c(c1Cl)cccc2

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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 C20H21ClN2OS2 MW 404.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2OS2/c21-16-14-3-1-2-4-15(14)26-17(16)18(24)22-19(25)23-20-8-11-5-12(9-20)7-13(6-11)10-20/h1-4,11-13H,5-10H2,(H2,22,23,24,25)
InChIKey
WFDSBFYBWADRAD-UHFFFAOYSA-N
Synonyms
530127-43-6
3chloroN(tricyclo(3311~37~)dec1ylcarbamothioyl)1benzothiophene2carboxamide
530127436
C1C2CC3CC1CC(C2)(C3)NC(=S)NC(=O)C4=C(C5=CC=CC=C5S4)Cl
InChI=1SC20H21ClN2OS2c211614312415(14)2617(16)18(24)2219(25)2320811512(920)713(611)1020h141113H510H2(H222232425)
MFCD03563678
N((3s5s7s)adamantan1ylcarbamothioyl)3chlorobenzo(b)thiophene2carboxamide
N(1ADAMANTYLCARBAMOTHIOYL)3CHLORO1BENZOTHIOPHENE2CARBOXAMIDE
S=C(NC12CC3CC(C2)CC(C1)C3)NC(=O)c1sc2c(c1Cl)cccc2
STK032183
ZINC000004604032
ZINC04604032
ZINC4604032

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Available files

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