Vitas-M small molecule compound
2-(benzylsulfanyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK080669
SMILES COc1ccc(cc1)n1c(SCc2ccccc2)nc2c(c1=O)c1CCCCc1s2
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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 C24H22N2O2S2 MW 434.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O2S2/c1-28-18-13-11-17(12-14-18)26-23(27)21-19-9-5-6-10-20(19)30-22(21)25-24(26)29-15-16-7-3-2-4-8-16/h2-4,7-8,11-14H,5-6,9-10,15H2,1H3InChIKey
IODUMZAJXLGNOK-UHFFFAOYSA-NSynonyms
312585-65-22(benzylsulfanyl)3(4methoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(benzylthio)3(4methoxyphenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2benzylsulfanyl3(4methoxyphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
312585652
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=CC=C4)SC5=C3CCCC5
COc1ccc(cc1)n1c(SCc2ccccc2)nc2c(c1=O)c1CCCCc1s2
InChI=1SC24H22N2O2S2c12818131117(121418)2623(27)21199561020(19)3022(21)2524(26)2915167324816h24781114H5691015H21H3
MFCD01465996
STK080669
ZINC000002081412
ZINC02081412
ZINC2081412
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