Vitas-M small molecule compound

4-bromo-N-(3-cyano-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide

Catalog ID
STK302392
SMILES N#Cc1c(sc2c1CCCCCCCCCC2)NC(=O)c1nn(c(c1Br)C)C

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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 C21H27BrN4OS MW 463.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27BrN4OS/c1-14-18(22)19(25-26(14)2)20(27)24-21-16(13-23)15-11-9-7-5-3-4-6-8-10-12-17(15)28-21/h3-12H2,1-2H3,(H,24,27)
InChIKey
UOEJPJFSAVCPLA-UHFFFAOYSA-N
Synonyms
512823-97-1
4bromoN(3cyano45678910111213decahydrocyclododeca(b)thiophen2yl)15dimethyl1Hpyrazole3carboxamide
4bromoN(3cyano45678910111213decahydrocyclododeca(b)thiophen2yl)15dimethylpyrazole3carboxamide
512823971
CC1=C(C(=NN1C)C(=O)NC2=C(C3=C(S2)CCCCCCCCCC3)C#N)Br
InChI=1SC21H27BrN4OSc11418(22)19(2526(14)2)20(27)242116(1323)15119753468101217(15)2821h312H212H3(H2427)
MFCD03468465
ZINC000002735456
ZINC02735456
ZINC2735456

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Available files

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