Vitas-M small molecule compound
methyl {[2-(benzylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}acetate
Catalog ID
STK845240
SMILES COC(=O)CSc1nc(SCc2ccccc2)nc2c1c1CC(C)(C)OCc1s2
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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 C21H22N2O3S3 MW 446.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S3/c1-21(2)9-14-15(10-26-21)29-19-17(14)18(27-12-16(24)25-3)22-20(23-19)28-11-13-7-5-4-6-8-13/h4-8H,9-12H2,1-3H3InChIKey
UVTIGPMPJIGEOE-UHFFFAOYSA-NSynonyms
573706-71-5573706715
CC1(CC2=C(CO1)SC3=C2C(=NC(=N3)SCC4=CC=CC=C4)SCC(=O)OC)C
InChI=1SC21H22N2O3S3c121(2)91415(102621)291917(14)18(271216(24)253)2220(2319)2811137546813h48H912H213H3
methyl((2(benzylsulfanyl)66dimethyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidin4yl)sulfanyl)acetate
methyl2((2(benzylthio)66dimethyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin4yl)thio)acetate
methyl2((2benzylsulfanyl66dimethyl58dihydropyrano(23)thieno(24b)pyrimidin4yl)sulfanyl)acetate
MFCD04018121
ZINC000002445425
ZINC02445425
ZINC2445425
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