Vitas-M small molecule compound
methyl 2-[({[3-ethyl-7-(4-methylphenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL104987
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc2c(csc2c(=O)n1CC)c1ccc(cc1)C
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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 C25H23N3O4S2 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O4S2/c1-4-28-23(30)22-21(18(13-33-22)16-11-9-15(2)10-12-16)27-25(28)34-14-20(29)26-19-8-6-5-7-17(19)24(31)32-3/h5-13H,4,14H2,1-3H3,(H,26,29)InChIKey
NCPZYUKKAUOBEA-UHFFFAOYSA-NSynonyms
1040651-44-21040651442
CCN1C(=O)C2=C(C(=CS2)C3=CC=C(C=C3)C)N=C1SCC(=O)NC4=CC=CC=C4C(=O)OC
InChI=1SC25H23N3O4S2c142823(30)2221(18(133322)1611915(2)101216)2725(28)341420(29)2619865717(19)24(31)323h513H414H213H3(H2629)
methyl2((((3ethyl7(4methylphenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
METHYL2((((3ETHYL7(4METHYLPHENYL)4OXO34DIHYDROTHIENO(32D)PYRIMIDIN2YL)THIO)ACETYL)AMINO)BENZOATE
methyl2((2(3ethyl7(4methylphenyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
METHYL2(2((3ETHYL4OXO7(PTOLYL)34DIHYDROTHIENO(32D)PYRIMIDIN2YL)THIO)ACETAMIDO)BENZOATE
MFCD11997477
ZINC000016846243
ZINC16846243
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