Vitas-M small molecule compound

5-(4-chlorophenyl)-2-phenyl-6,8-dithiabicyclo[3.2.1]octane-3,3,4,4-tetracarbonitrile

Catalog ID
STK331007
SMILES N#CC1(C#N)C2(SCC(S2)C(C1(C#N)C#N)c1ccccc1)c1ccc(cc1)Cl

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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 C22H13ClN4S2 MW 432.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13ClN4S2/c23-17-8-6-16(7-9-17)22-21(13-26,14-27)20(11-24,12-25)19(18(29-22)10-28-22)15-4-2-1-3-5-15/h1-9,18-19H,10H2
InChIKey
VTZUWSRPCOMUTP-UHFFFAOYSA-N
Synonyms
172789-47-8
172789478
5(4chlorophenyl)2phenyl68dithiabicyclo(321)octane3344tetracarbonitrile
C1C2C(C(C(C(S1)(S2)C3=CC=C(C=C3)Cl)(C#N)C#N)(C#N)C#N)C4=CC=CC=C4
InChI=1SC22H13ClN4S2c23178616(7917)2221(13261427)20(11241225)19(18(2922)102822)154213515h191819H10H2
MFCD09962431
ZINC000102038621
ZINC000102038626

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Available files

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