Vitas-M small molecule compound

12-methyl-7-(prop-2-en-1-ylsulfanyl)-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine

Catalog ID
STK591050
SMILES C=CCSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(CC3)C

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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 C16H16N6S2 MW 356.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6S2/c1-3-6-23-16-20-19-15-21(16)14-12(13-17-8-18-22(13)15)10-7-9(2)4-5-11(10)24-14/h3,8-9H,1,4-7H2,2H3
InChIKey
CLUXGBODEFRSAV-UHFFFAOYSA-N
Synonyms
877799-25-2
12methyl7(prop2en1ylsulfanyl)10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidine
7(allylthio)12methyl10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidine
877799252
CC1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC=C)N5C3=NC=N5
InChI=1SC16H16N6S2c136231620191521(16)1412(131781822(13)15)1079(2)4511(10)2414h389H147H22H3
MFCD05703692
ZINC000005574602
ZINC000005574609

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Available files

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