Vitas-M small molecule compound
3-(4-methoxyphenyl)-7-methyl-2-[(3-methylbutyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK283401
SMILES COc1ccc(cc1)n1c(SCCC(C)C)nc2c(c1=O)c1CCC(Cc1s2)C
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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 C23H28N2O2S2 MW 428.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O2S2/c1-14(2)11-12-28-23-24-21-20(18-10-5-15(3)13-19(18)29-21)22(26)25(23)16-6-8-17(27-4)9-7-16/h6-9,14-15H,5,10-13H2,1-4H3InChIKey
QRXICAQHVSTIDH-UHFFFAOYSA-NSynonyms
2(isopentylthio)3(4methoxyphenyl)7methyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(4methoxyphenyl)7methyl2((3methylbutyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4methoxyphenyl)7methyl2(3methylbutylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCCC(C)C)C4=CC=C(C=C4)OC
InChI=1SC23H28N2O2S2c114(2)11122823242120(1810515(3)1319(18)2921)22(26)25(23)166817(274)9716h691415H51013H214H3
MFCD02234708
ZINC000002292876
ZINC000012436698
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