Vitas-M small molecule compound
1-(ethylsulfanyl)-4-(2-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK532564
SMILES CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)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 C20H20N4OS2 MW 396.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4OS2/c1-3-26-20-22-21-19-23(14-10-6-4-8-12(14)2)17(25)16-13-9-5-7-11-15(13)27-18(16)24(19)20/h4,6,8,10H,3,5,7,9,11H2,1-2H3InChIKey
INKLZVKTWJFGFQ-UHFFFAOYSA-NSynonyms
1(ethylsulfanyl)4(2methylphenyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(ethylthio)4(otolyl)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CCSC1=NN=C2N1C3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5C
InChI=1SC20H20N4OS2c13262022211923(141064812(14)2)17(25)16139571115(13)2718(16)24(19)20h46810H357911H212H3
MFCD02986650
ZINC000002293379
ZINC02293379
ZINC2293379
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