Vitas-M small molecule compound
2-(1,3-benzodioxol-5-yl)-7-methyl-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STK382100
SMILES CC1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc2c(c1)OCO2
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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 C18H18N2O3S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O3S/c1-9-2-4-11-14(6-9)24-18-15(11)17(21)19-16(20-18)10-3-5-12-13(7-10)23-8-22-12/h3,5,7,9,16,20H,2,4,6,8H2,1H3,(H,19,21)InChIKey
RJHDQNKISLXJRQ-UHFFFAOYSA-NSynonyms
2(13benzodioxol5yl)7methyl235678hexahydro(1)benzothieno(23d)pyrimidin4(1H)one
2(13benzodioxol5yl)7methyl235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC5=C(C=C4)OCO5
InChI=1SC18H18N2O3Sc19241114(69)241815(11)17(21)1916(2018)10351213(710)2382212h35791620H2468H21H3(H1921)
MFCD02915412
ZINC000004543260
ZINC000004543263
ZINC00556064
ZINC00556065
ZINC00556067
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