Vitas-M small molecule compound
ethyl (2Z)-7-methyl-2-[(5-nitrofuran-2-yl)methylidene]-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK698411
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1ccc(o1)[N+](=O)[O-])/s2
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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 C19H15N3O6S2 MW 445.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O6S2/c1-3-27-18(24)15-10(2)20-19-21(16(15)12-5-4-8-29-12)17(23)13(30-19)9-11-6-7-14(28-11)22(25)26/h4-9,16H,3H2,1-2H3/b13-9-InChIKey
PYFJSYVZEOICOH-LCYFTJDESA-NSynonyms
(E)ethyl7methyl2((5nitrofuran2yl)methylene)3oxo5(thiophen2yl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1ccc(o1)(N+)(=O)(O))s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CC=C(O4)(N+)(=O)(O))S2)C
ethyl(2Z)7methyl2((5nitrofuran2yl)methylidene)3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)7METHYL2((5NITROFURAN2YL)METHYLIDENE)3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC19H15N3O6S2c132718(24)1510(2)201921(16(15)125482912)17(23)13(3019)9116714(2811)22(25)26h4916H3H212H3b139
MFCD02109417
ZINC000002298229
ZINC000002298231
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