Vitas-M small molecule compound
2-[(3,4-dichlorobenzyl)sulfanyl]-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK080017
SMILES CCOc1ccc(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 C25H22Cl2N2O2S2 MW 517.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2O2S2/c1-2-31-17-10-8-16(9-11-17)29-24(30)22-18-5-3-4-6-21(18)33-23(22)28-25(29)32-14-15-7-12-19(26)20(27)13-15/h7-13H,2-6,14H2,1H3InChIKey
YLGKRYRPBJDGIP-UHFFFAOYSA-NSynonyms
499125-43-82((34dichlorobenzyl)sulfanyl)3(4ethoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((34dichlorobenzyl)thio)3(4ethoxyphenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2((34dichlorophenyl)methylsulfanyl)3(4ethoxyphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
499125438
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC(=C(C=C4)Cl)Cl)SC5=C3CCCC5
CCOc1ccc(cc1)n1c(SCc2ccc(c(c2)Cl)Cl)nc2c(c1=O)c1CCCCc1s2
InChI=1SC25H22Cl2N2O2S2c12311710816(91117)2924(30)2218534621(18)3323(22)2825(29)32141571219(26)20(27)1315h713H2614H21H3
MFCD03474427
STK080017
ZINC000001794730
ZINC01794730
ZINC1794730
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