Vitas-M small molecule compound
1-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK064130
SMILES CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)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 C21H20N4OS2 MW 408.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4OS2/c1-13(2)12-27-21-23-22-20-24(14-8-4-3-5-9-14)18(26)17-15-10-6-7-11-16(15)28-19(17)25(20)21/h3-5,8-9H,1,6-7,10-12H2,2H3InChIKey
XUPTWUGQCKXBFI-UHFFFAOYSA-NSynonyms
316358-26-61((2methylallyl)thio)4phenyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((2methylprop2en1yl)sulfanyl)4phenyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
316358266
CC(=C)CSC1=NN=C2N1C3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5
CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3
InChI=1SC21H20N4OS2c113(2)12272123222024(148435914)18(26)171510671116(15)2819(17)25(20)21h3589H1671012H22H3
MFCD01557397
STK064130
ZINC000002361859
ZINC02361859
ZINC2361859
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