Vitas-M small molecule compound

3-(4-bromophenyl)-2-[(4-fluorobenzyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STK090965
SMILES Fc1ccc(cc1)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 C23H18BrFN2OS2 MW 501.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrFN2OS2/c24-15-7-11-17(12-8-15)27-22(28)20-18-3-1-2-4-19(18)30-21(20)26-23(27)29-13-14-5-9-16(25)10-6-14/h5-12H,1-4,13H2
InChIKey
YGWZTZZRYQPYHI-UHFFFAOYSA-N
Synonyms
498546-91-1
3(4bromophenyl)2((4fluorobenzyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4bromophenyl)2((4fluorobenzyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(4bromophenyl)2((4fluorophenyl)methylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
498546911
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=C(C=C4)Br)SCC5=CC=C(C=C5)F
Fc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Br)CCCC3
InChI=1SC23H18BrFN2OS2c241571117(12815)2722(28)2018312419(18)3021(20)2623(27)2913145916(25)10614h512H1413H2
MFCD03223083
STK090965
ZINC000001824615
ZINC01824615
ZINC1824615

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.