Vitas-M small molecule compound
ethyl 4-{[({[5,6-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]methyl}benzoate
Catalog ID
STK844519
SMILES CCOC(=O)c1ccc(cc1)CNC(=O)CSc1nc2sc(c(c2c(=O)n1CC=C)C)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 C23H25N3O4S2 MW 471.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O4S2/c1-5-11-26-21(28)19-14(3)15(4)32-20(19)25-23(26)31-13-18(27)24-12-16-7-9-17(10-8-16)22(29)30-6-2/h5,7-10H,1,6,11-13H2,2-4H3,(H,24,27)InChIKey
CUACHGSCSLHFGZ-UHFFFAOYSA-NSynonyms
501112-72-7501112727
CCOC(=O)C1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2CC=C
ethyl4(((((56dimethyl4oxo3(prop2en1yl)34dihydrothieno(23d)pyrimidin2yl)sulfanyl)acetyl)amino)methyl)benzoate
ETHYL4(((2(56DIMETHYL4OXO3PROP2ENYLTHIENO(23D)PYRIMIDIN2YL)SULFANYLACETYL)AMINO)METHYL)BENZOATE
ethyl4((2((3allyl56dimethyl4oxo34dihydrothieno(23d)pyrimidin2yl)thio)acetamido)methyl)benzoate
ETHYL4((2(56DIMETHYL4OXO3PROP2ENYL3HYDROTHIOPHENO(23D)PYRIMIDIN2YLTHIO)ACETYLAMINO)METHYL)BENZOATE
InChI=1SC23H25N3O4S2c15112621(28)1914(3)15(4)3220(19)2523(26)311318(27)2412167917(10816)22(29)3062h5710H161113H224H3(H2427)
MFCD03621090
ZINC000001144444
ZINC01144444
ZINC1144444
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