Vitas-M small molecule compound
3-(2-methylphenyl)-2-(pentylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK283357
SMILES CCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)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 C22H26N2OS2 MW 398.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2OS2/c1-3-4-9-14-26-22-23-20-19(16-11-6-8-13-18(16)27-20)21(25)24(22)17-12-7-5-10-15(17)2/h5,7,10,12H,3-4,6,8-9,11,13-14H2,1-2H3InChIKey
HTWQAGGYHICPJI-UHFFFAOYSA-NSynonyms
2(pentylthio)3(otolyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(2methylphenyl)2(pentylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(2methylphenyl)2pentylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCCCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=CC=C4C
InChI=1SC22H26N2OS2c1349142622232019(1611681318(16)2720)21(25)24(22)1712751015(17)2h571012H34689111314H212H3
MFCD02985071
ZINC000001774618
ZINC01774618
ZINC1774618
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