Vitas-M small molecule compound

7-tert-butyl-2-(3,5-dibromo-2-hydroxyphenyl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

Catalog ID
STK834340
SMILES Brc1cc(Br)c(c(c1)C1NC(=O)c2c(N1)sc1c2CCC(C1)C(C)(C)C)O

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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 C20H22Br2N2O2S MW 514.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22Br2N2O2S/c1-20(2,3)9-4-5-11-14(6-9)27-19-15(11)18(26)23-17(24-19)12-7-10(21)8-13(22)16(12)25/h7-9,17,24-25H,4-6H2,1-3H3,(H,23,26)
InChIKey
UPYGXEQPDWITFU-UHFFFAOYSA-N
Synonyms
328568-63-4
328568634
7(tertbutyl)2(35dibromo2hydroxyphenyl)235678hexahydrobenzo(45)thieno(23d)pyrimidin4(1H)one
7tertbutyl2(35dibromo2hydroxyphenyl)235678hexahydro(1)benzothieno(23d)pyrimidin4(1H)one
7tertbutyl2(35dibromo2hydroxyphenyl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=CC(=C4O)Br)Br
InChI=1SC20H22Br2N2O2Sc120(23)9451114(69)271915(11)18(26)2317(2419)12710(21)813(22)16(12)25h79172425H46H213H3(H2326)
MFCD01039382
ZINC000002062242
ZINC000002062245

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Available files

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