Vitas-M small molecule compound
3-(4-methoxyphenyl)-7-methyl-2-(propan-2-ylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK283387
SMILES COc1ccc(cc1)n1c(SC(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 C21H24N2O2S2 MW 400.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O2S2/c1-12(2)26-21-22-19-18(16-10-5-13(3)11-17(16)27-19)20(24)23(21)14-6-8-15(25-4)9-7-14/h6-9,12-13H,5,10-11H2,1-4H3InChIKey
CWLAWHOFRCZCHU-UHFFFAOYSA-NSynonyms
2(isopropylthio)3(4methoxyphenyl)7methyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(4methoxyphenyl)7methyl2(propan2ylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4methoxyphenyl)7methyl2propan2ylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SC(C)C)C4=CC=C(C=C4)OC
InChI=1SC21H24N2O2S2c112(2)2621221918(1610513(3)1117(16)2719)20(24)23(21)146815(254)9714h691213H51011H214H3
MFCD02242480
ZINC000001812127
ZINC000001812128
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