Vitas-M small molecule compound
N'-[(Z)-(5-bromo-2-fluorophenyl)methylidene]-2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetohydrazide
Catalog ID
STL036348
SMILES O=C(CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3)N/N=C\c1cc(Br)ccc1F
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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 C26H22BrFN4O2S2 MW 585.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22BrFN4O2S2/c1-15-6-9-18(10-7-15)32-25(34)23-19-4-2-3-5-21(19)36-24(23)30-26(32)35-14-22(33)31-29-13-16-12-17(27)8-11-20(16)28/h6-13H,2-5,14H2,1H3,(H,31,33)/b29-13-InChIKey
TWMPRQKKNCNNNF-DBFSUHOCSA-NSynonyms
(Z)N(5bromo2fluorobenzylidene)2((4oxo3(ptolyl)345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetohydrazide
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NN=CC4=C(C=CC(=C4)Br)F)SC5=C3CCCC5
InChI=1SC26H22BrFN4O2S2c1156918(10715)3225(34)2319423521(19)3624(23)3026(32)351422(33)312913161217(27)81120(16)28h613H2514H21H3(H3133)b2913
MFCD03217652
N((Z)(5bromo2fluorophenyl)methylidene)2((3(4methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetohydrazide
N((Z)(5bromo2fluorophenyl)methylideneamino)2((3(4methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
O=C(CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3)NN=Cc1cc(Br)ccc1F
ZINC000097968908
ZINC01884107
ZINC1884107
Check stock
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Check stock on Vitas-MAvailable files
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