Vitas-M small molecule compound

2-benzyl-6-(2-methylprop-2-en-1-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5(6H)-one

Catalog ID
STK933173
SMILES CC(=C)Cn1c(=O)n2nc(nc2c2c1sc1c2CCCC1)Cc1ccccc1

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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 C22H22N4OS MW 390.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4OS/c1-14(2)13-25-21-19(16-10-6-7-11-17(16)28-21)20-23-18(24-26(20)22(25)27)12-15-8-4-3-5-9-15/h3-5,8-9H,1,6-7,10-13H2,2H3
InChIKey
SKVOYXBXMVXCSJ-UHFFFAOYSA-N
Synonyms
951986-95-1
2benzyl6(2methylallyl)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidin5(6H)one
2benzyl6(2methylprop2en1yl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidin5(6H)one
951986951
CC(=C)CN1C2=C(C3=C(S2)CCCC3)C4=NC(=NN4C1=O)CC5=CC=CC=C5
InChI=1SC22H22N4OSc114(2)13252119(1610671117(16)2821)202318(2426(20)22(25)27)12158435915h3589H1671013H22H3
MFCD09851631
ZINC000013690277
ZINC13690277

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Available files

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