Vitas-M small molecule compound
3-(4-chlorophenyl)-2-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK062588
SMILES COc1ccc(c(c1)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCCC3)OC
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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 C26H23ClN2O4S2 MW 527.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O4S2/c1-32-17-11-12-21(33-2)19(13-17)20(30)14-34-26-28-24-23(18-5-3-4-6-22(18)35-24)25(31)29(26)16-9-7-15(27)8-10-16/h7-13H,3-6,14H2,1-2H3InChIKey
SJMHCPBTNFKXNN-UHFFFAOYSA-NSynonyms
499102-51-13(4chlorophenyl)2((2(25dimethoxyphenyl)2oxoethyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4chlorophenyl)2((2(25dimethoxyphenyl)2oxoethyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(4chlorophenyl)2(2(25dimethoxyphenyl)2oxoethyl)sulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
499102511
COC1=CC(=C(C=C1)OC)C(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)Cl
COc1ccc(c(c1)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCCC3)OC
InChI=1SC26H23ClN2O4S2c13217111221(332)19(1317)20(30)143426282423(18534622(18)3524)25(31)29(26)169715(27)81016h713H3614H212H3
MFCD03223867
STK062588
ZINC000001774589
ZINC01774589
ZINC1774589
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