Vitas-M small molecule compound

Catalog ID
STK666436
SMILES O=c1n(cnc2c1c1CCCc1s2)Cc1ccc2c(c1)nsn2

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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 C16H12N4OS2 MW 340.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4OS2/c21-16-14-10-2-1-3-13(10)22-15(14)17-8-20(16)7-9-4-5-11-12(6-9)19-23-18-11/h4-6,8H,1-3,7H2
InChIKey
GINJOPYYDOFYCY-UHFFFAOYSA-N
Synonyms

2(213benzothiadiazol5ylmethyl)78dihydro6Hcyclopenta(23)thieno(24d)pyrimidin1one
C1CC2=C(C1)SC3=C2C(=O)N(C=N3)CC4=CC5=NSN=C5C=C4
InChI=1SC16H12N4OS2c2116141021313(10)2215(14)17820(16)79451112(69)19231811h468H137H2
MFCD09763940
ZINC000012375132
ZINC12375132

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Available files

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