Vitas-M small molecule compound
ethyl 4-({(Z)-[1-(4-fluorobenzyl)-2,2-dioxido-4-oxo-1,4-dihydro-3H-thieno[3,2-c][1,2]thiazin-3-ylidene]methyl}amino)benzoate
Catalog ID
STL081881
SMILES CCOC(=O)c1ccc(cc1)N/C=C\1/C(=O)c2sccc2N(S1(=O)=O)Cc1ccc(cc1)F
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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 C23H19FN2O5S2 MW 486.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19FN2O5S2/c1-2-31-23(28)16-5-9-18(10-6-16)25-13-20-21(27)22-19(11-12-32-22)26(33(20,29)30)14-15-3-7-17(24)8-4-15/h3-13,25H,2,14H2,1H3/b20-13-InChIKey
PNXNPFJAKQOETH-MOSHPQCFSA-NSynonyms
894681-71-1894681711
CCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)C3=C(C=CS3)N(S2(=O)=O)CC4=CC=C(C=C4)F
CCOC(=O)c1ccc(cc1)NC=C1C(=O)c2sccc2N(S1(=O)=O)Cc1ccc(cc1)F
ethyl4(((Z)(1((4fluorophenyl)methyl)224trioxothieno(32c)thiazin3ylidene)methyl)amino)benzoate
ethyl4(((Z)(1(4fluorobenzyl)22dioxido4oxo14dihydro3Hthieno(32c)(12)thiazin3ylidene)methyl)amino)benzoate
InChI=1SC23H19FN2O5S2c123123(28)165918(10616)25132021(27)2219(11123222)26(33(2029)30)14153717(24)8415h31325H214H21H3b2013
MFCD14930855
ZINC000020575788
ZINC20575788
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