Vitas-M small molecule compound
2-{[2-(2,5-dichlorothiophen-3-yl)-2-oxoethyl]sulfanyl}-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL054217
SMILES CCOc1ccc(cc1)n1c(SCC(=O)c2cc(sc2Cl)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 C24H20Cl2N2O3S3 MW 551.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20Cl2N2O3S3/c1-2-31-14-9-7-13(8-10-14)28-23(30)20-15-5-3-4-6-18(15)33-22(20)27-24(28)32-12-17(29)16-11-19(25)34-21(16)26/h7-11H,2-6,12H2,1H3InChIKey
DTKUMIWGNPTKEV-UHFFFAOYSA-NSynonyms
2((2(25dichlorothiophen3yl)2oxoethyl)sulfanyl)3(4ethoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((2(25dichlorothiophen3yl)2oxoethyl)thio)3(4ethoxyphenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2(2(25dichlorothiophen3yl)2oxoethyl)sulfanyl3(4ethoxyphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=C(SC(=C4)Cl)Cl)SC5=C3CCCC5
InChI=1SC24H20Cl2N2O3S3c1231149713(81014)2823(30)2015534618(15)3322(20)2724(28)321217(29)161119(25)3421(16)26h711H2612H21H3
MFCD03301073
ZINC000001884776
ZINC01884776
ZINC1884776
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