Vitas-M small molecule compound
3-(4-ethoxyphenyl)-2-(propylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL369886
SMILES CCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OCC)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 C21H24N2O2S2 MW 400.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O2S2/c1-3-13-26-21-22-19-18(16-7-5-6-8-17(16)27-19)20(24)23(21)14-9-11-15(12-10-14)25-4-2/h9-12H,3-8,13H2,1-2H3InChIKey
YHFKGORAKLCNJK-UHFFFAOYSA-NSynonyms
3(4ethoxyphenyl)2(propylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4ethoxyphenyl)2propylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)OCC
InChI=1SC21H24N2O2S2c13132621221918(16756817(16)2719)20(24)23(21)1491115(121014)2542h912H3813H212H3
MFCD03864571
ZINC000002143125
ZINC02143125
ZINC2143125
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