Vitas-M small molecule compound
3-(4-chlorophenyl)-2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK033267
SMILES COc1cc(ccc1OC)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)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 C26H23ClN2O4S2 MW 527.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O4S2/c1-32-20-12-7-15(13-21(20)33-2)19(30)14-34-26-28-24-23(18-5-3-4-6-22(18)35-24)25(31)29(26)17-10-8-16(27)9-11-17/h7-13H,3-6,14H2,1-2H3InChIKey
DSDFNEPYXHTVOX-UHFFFAOYSA-NSynonyms
499102-50-03(4chlorophenyl)2((2(34dimethoxyphenyl)2oxoethyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4chlorophenyl)2((2(34dimethoxyphenyl)2oxoethyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(4chlorophenyl)2(2(34dimethoxyphenyl)2oxoethyl)sulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
499102500
COC1=C(C=C(C=C1)C(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)Cl)OC
COc1cc(ccc1OC)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCCC3
InChI=1SC26H23ClN2O4S2c1322012715(1321(20)332)19(30)143426282423(18534622(18)3524)25(31)29(26)1710816(27)91117h713H3614H212H3
MFCD03223866
STK033267
ZINC000001829040
ZINC01829040
ZINC1829040
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