Vitas-M small molecule compound
1-(ethylsulfanyl)-8-methyl-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
STK722741
SMILES CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC(C3)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 C20H20N4OS2 MW 396.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4OS2/c1-3-26-20-22-21-19-23(13-7-5-4-6-8-13)17(25)16-14-10-9-12(2)11-15(14)27-18(16)24(19)20/h4-8,12H,3,9-11H2,1-2H3InChIKey
ZGZDCHHOAYNSOQ-UHFFFAOYSA-NSynonyms
1(ethylsulfanyl)8methyl4phenyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(ethylthio)8methyl4phenyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CCSC1=NN=C2N1C3=C(C4=C(S3)CC(CC4)C)C(=O)N2C5=CC=CC=C5
InChI=1SC20H20N4OS2c13262022211923(137546813)17(25)161410912(2)1115(14)2718(16)24(19)20h4812H3911H212H3
MFCD02239979
ZINC000000985941
ZINC000000985942
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