Vitas-M small molecule compound
4-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylsulfanyl)methyl]benzoic acid
Catalog ID
STL347656
SMILES OC(=O)c1ccc(cc1)CSc1ncnc2c1c1CCCCc1s2
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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 C18H16N2O2S2 MW 356.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O2S2/c21-18(22)12-7-5-11(6-8-12)9-23-16-15-13-3-1-2-4-14(13)24-17(15)20-10-19-16/h5-8,10H,1-4,9H2,(H,21,22)InChIKey
SBOSHHPCNRHJLS-UHFFFAOYSA-NSynonyms
526188-32-94(((5678tetrahydrobenzo(45)thieno(23d)pyrimidin4yl)thio)methyl)benzoicacid
4((5678tetrahydro(1)benzothieno(23d)pyrimidin4ylsulfanyl)methyl)benzoicacid
4(5678tetrahydro(1)benzothiolo(23d)pyrimidin4ylsulfanylmethyl)benzoicacid
526188329
C1CCC2=C(C1)C3=C(S2)N=CN=C3SCC4=CC=C(C=C4)C(=O)O
InChI=1SC18H16N2O2S2c2118(22)127511(6812)923161513312414(13)2417(15)20101916h5810H149H2(H2122)
MFCD03277323
ZINC000000781890
ZINC781890
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