Vitas-M small molecule compound
(2E)-N-(3-ethoxyphenyl)-2-{(2E)-[1-(3-fluoro-4-methoxyphenyl)ethylidene]hydrazinylidene}-4-oxo-1,3-thiazinane-6-carboxamide
Catalog ID
STK073516
SMILES CCOc1cccc(c1)NC(=O)C1S/C(=N/N=C(/c2ccc(c(c2)F)OC)\C)/NC(=O)C1
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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 C22H23FN4O4S MW 458.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN4O4S/c1-4-31-16-7-5-6-15(11-16)24-21(29)19-12-20(28)25-22(32-19)27-26-13(2)14-8-9-18(30-3)17(23)10-14/h5-11,19H,4,12H2,1-3H3,(H,24,29)(H,25,27,28)/b26-13+InChIKey
MOPFUDNRILBZDY-LGJNPRDNSA-NSynonyms
(2E)N(3ETHOXYPHENYL)2((2E)(1(3FLUORO4METHOXYPHENYL)ETHYLIDENE)HYDRAZINYLIDENE)4OXO13THIAZINANE6CARBOXAMIDE
CCOC1=CC=CC(=C1)NC(=O)C2CC(=O)N=C(S2)NN=C(C)C3=CC(=C(C=C3)OC)F
CCOc1cccc(c1)NC(=O)C1SC(=NN=C(c2ccc(c(c2)F)OC)C)NC(=O)C1
InChI=1SC22H23FN4O4Sc14311675615(1116)2421(29)191220(28)2522(3219)272613(2)148918(303)17(23)1014h51119H412H213H3(H2429)(H252728)b2613+
MFCD02230504
N(3ethoxyphenyl)2((2E)2(1(3fluoro4methoxyphenyl)ethylidene)hydrazinyl)4oxo56dihydro13thiazine6carboxamide
STK073516
ZINC000006631326
ZINC000013423979
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