Vitas-M small molecule compound

2-{[3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide

Catalog ID
STK055417
SMILES O=C(Nc1ccc(cc1)F)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Br)CCCC3

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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 C24H19BrFN3O2S2 MW 544.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19BrFN3O2S2/c25-14-5-11-17(12-6-14)29-23(31)21-18-3-1-2-4-19(18)33-22(21)28-24(29)32-13-20(30)27-16-9-7-15(26)8-10-16/h5-12H,1-4,13H2,(H,27,30)
InChIKey
RHWGVCFESGTLSA-UHFFFAOYSA-N
Synonyms
498545-64-5
2((3(4bromophenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(4fluorophenyl)acetamide
2((3(4bromophenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(4fluorophenyl)acetamide
2((3(4bromophenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(4fluorophenyl)acetamide
498545645
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=C(C=C4)Br)SCC(=O)NC5=CC=C(C=C5)F
InChI=1SC24H19BrFN3O2S2c251451117(12614)2923(31)2118312419(18)3322(21)2824(29)321320(30)27169715(26)81016h512H1413H2(H2730)
MFCD03223116
O=C(Nc1ccc(cc1)F)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Br)CCCC3
STK055417
ZINC000002232073
ZINC2232073

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Available files

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