Vitas-M small molecule compound
2-[(3,4-dichlorobenzyl)sulfanyl]-3-(4-ethylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL369856
SMILES CCc1ccc(cc1)n1c(SCc2ccc(c(c2)Cl)Cl)nc2c(c1=O)c1CCCCc1s2
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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 C25H22Cl2N2OS2 MW 501.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2OS2/c1-2-15-7-10-17(11-8-15)29-24(30)22-18-5-3-4-6-21(18)32-23(22)28-25(29)31-14-16-9-12-19(26)20(27)13-16/h7-13H,2-6,14H2,1H3InChIKey
IJGOCIZUMBPQMZ-UHFFFAOYSA-NSynonyms
2((34dichlorobenzyl)sulfanyl)3(4ethylphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((34dichlorophenyl)methylsulfanyl)3(4ethylphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC(=C(C=C4)Cl)Cl)SC5=C3CCCC5
InChI=1SC25H22Cl2N2OS2c121571017(11815)2924(30)2218534621(18)3223(22)2825(29)31141691219(26)20(27)1316h713H2614H21H3
MFCD03864626
ZINC000002143284
ZINC02143284
ZINC2143284
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