Vitas-M small molecule compound
1-(ethylsulfanyl)-7,7-dimethyl-4-(3-methylphenyl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK605341
SMILES CCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)(C)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 C21H22N4O2S2 MW 426.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S2/c1-5-28-20-23-22-19-24(13-8-6-7-12(2)9-13)17(26)16-14-10-21(3,4)27-11-15(14)29-18(16)25(19)20/h6-9H,5,10-11H2,1-4H3InChIKey
SSQDZHGNPVZCIU-UHFFFAOYSA-NSynonyms
370574-83-71(ethylsulfanyl)77dimethyl4(3methylphenyl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(ethylthio)77dimethyl4(mtolyl)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
370574837
CCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)(C)C)C(=O)N2C5=CC=CC(=C5)C
InChI=1SC21H22N4O2S2c15282023221924(1386712(2)913)17(26)16141021(34)271115(14)2918(16)25(19)20h69H51011H214H3
MFCD03011137
ZINC000002316536
ZINC02316536
ZINC2316536
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