Vitas-M small molecule compound

5-(2-chlorophenyl)-3-[(2-methylprop-2-en-1-yl)sulfanyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine

Catalog ID
STK550413
SMILES CC(=C)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl

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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 C21H19ClN4S2 MW 426.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4S2/c1-12(2)11-27-21-25-24-19-17-14-8-4-6-10-16(14)28-20(17)23-18(26(19)21)13-7-3-5-9-15(13)22/h3,5,7,9H,1,4,6,8,10-11H2,2H3
InChIKey
BPQMDWAIKAXFSB-UHFFFAOYSA-N
Synonyms
799792-71-5
5(2chlorophenyl)3((2methylallyl)thio)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidine
5(2chlorophenyl)3((2methylprop2en1yl)sulfanyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidine
799792715
CC(=C)CSC1=NN=C2N1C(=NC3=C2C4=C(S3)CCCC4)C5=CC=CC=C5Cl
InChI=1SC21H19ClN4S2c112(2)11272125241917148461016(14)2820(17)2318(26(19)21)13735915(13)22h3579H14681011H22H3
MFCD03676665
ZINC000002218433
ZINC02218433
ZINC2218433

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Available files

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