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]benzoate
Catalog ID
STK841458
SMILES CCOC(=O)c1ccc(cc1)NC(=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 C22H23N3O4S2 MW 457.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4S2/c1-5-11-25-20(27)18-13(3)14(4)31-19(18)24-22(25)30-12-17(26)23-16-9-7-15(8-10-16)21(28)29-6-2/h5,7-10H,1,6,11-12H2,2-4H3,(H,23,26)InChIKey
WRMFJJUEGRNHII-UHFFFAOYSA-NSynonyms
488825-61-2488825612
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2CC=C
ethyl4((((56dimethyl4oxo3(prop2en1yl)34dihydrothieno(23d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2(56DIMETHYL4OXO3PROP2ENYLTHIENO(23D)PYRIMIDIN2YL)SULFANYLACETYL)AMINO)BENZOATE
ethyl4(2((3allyl56dimethyl4oxo34dihydrothieno(23d)pyrimidin2yl)thio)acetamido)benzoate
ETHYL4(2(56DIMETHYL4OXO3PROP2ENYL3HYDROTHIOPHENO(23D)PYRIMIDIN2YLTHIO)ACETYLAMINO)BENZOATE
InChI=1SC22H23N3O4S2c15112520(27)1813(3)14(4)3119(18)2422(25)301217(26)23169715(81016)21(28)2962h5710H161112H224H3(H2326)
MFCD03293946
ZINC000001465540
ZINC01465540
ZINC1465540
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