Vitas-M small molecule compound
2-(6-bromo-1,3-benzodioxol-5-yl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STK363433
SMILES Brc1cc2OCOc2cc1C1NC(=O)c2c(N1)sc1c2CCCC1
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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 C17H15BrN2O3S MW 407.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN2O3S/c18-10-6-12-11(22-7-23-12)5-9(10)15-19-16(21)14-8-3-1-2-4-13(8)24-17(14)20-15/h5-6,15,20H,1-4,7H2,(H,19,21)InChIKey
VEHUJIPXHNFFQU-UHFFFAOYSA-NSynonyms
2(6bromo13benzodioxol5yl)235678hexahydro(1)benzothieno(23d)pyrimidin4(1H)one
2(6bromo13benzodioxol5yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
C1CCC2=C(C1)C3=C(S2)NC(NC3=O)C4=CC5=C(C=C4Br)OCO5
InChI=1SC17H15BrN2O3Sc181061211(2272312)59(10)151916(21)148312413(8)2417(14)2015h561520H147H2(H1921)
MFCD00570176
ZINC000000856545
ZINC000000856546
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