Vitas-M small molecule compound

5-benzyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-c]pyrimidine

Catalog ID
STK854405
SMILES c1ccc(cc1)Cc1nc2sc3c(c2c2n1nnn2)CCCC3

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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 C17H15N5S MW 321.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N5S/c1-2-6-11(7-3-1)10-14-18-17-15(16-19-20-21-22(14)16)12-8-4-5-9-13(12)23-17/h1-3,6-7H,4-5,8-10H2
InChIKey
PPKRTFLGFONTEP-UHFFFAOYSA-N
Synonyms
83548-71-4
5benzyl891011tetrahydro(1)benzothieno(32e)tetrazolo(15c)pyrimidine
5benzyl891011tetrahydrobenzo(45)thieno(32e)tetrazolo(15c)pyrimidine
83548714
C1CCC2=C(C1)C3=C(S2)N=C(N4C3=NN=N4)CC5=CC=CC=C5
InChI=1SC17H15N5Sc12611(731)1014181715(1619202122(14)16)12845913(12)2317h1367H45810H2
MFCD02738003
ZINC000000316620
ZINC00316620
ZINC316620

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Available files

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