Vitas-M small molecule compound

2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(2-methylprop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STK840924
SMILES CC(=C)Cn1c(SCc2nc3c([nH]2)cccc3)nc2c(c1=O)c1CCCCc1s2

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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 C22H22N4OS2 MW 422.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4OS2/c1-13(2)11-26-21(27)19-14-7-3-6-10-17(14)29-20(19)25-22(26)28-12-18-23-15-8-4-5-9-16(15)24-18/h4-5,8-9H,1,3,6-7,10-12H2,2H3,(H,23,24)
InChIKey
ICLNQVWRANIKEY-UHFFFAOYSA-N
Synonyms
380474-63-5
2(((1Hbenzo(d)imidazol2yl)methyl)thio)3(2methylallyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2((1Hbenzimidazol2ylmethyl)sulfanyl)3(2methylprop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(1Hbenzimidazol2ylmethylsulfanyl)3(2methylprop2enyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
380474635
CC(=C)CN1C(=O)C2=C(N=C1SCC3=NC4=CC=CC=C4N3)SC5=C2CCCC5
CC(=C)Cn1c(SCc2nc3c((nH)2)cccc3)nc2c(c1=O)c1CCCCc1s2
InChI=1SC22H22N4OS2c113(2)112621(27)19147361017(14)2920(19)2522(26)2812182315845916(15)2418h4589H13671012H22H3(H2324)
MFCD03154928
ZINC000000909670
ZINC00909670
ZINC909670

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Available files

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