Vitas-M small molecule compound
ethyl (2Z)-5-amino-7-(2-chlorophenyl)-6-cyano-2-(2-methoxy-2-oxoethylidene)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Catalog ID
STL485349
SMILES CCOC(=O)C1=c2s/c(=C\C(=O)OC)/c(=O)n2C(=C(C1c1ccccc1Cl)C#N)N
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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 C20H16ClN3O5S MW 445.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN3O5S/c1-3-29-20(27)16-15(10-6-4-5-7-12(10)21)11(9-22)17(23)24-18(26)13(30-19(16)24)8-14(25)28-2/h4-8,15H,3,23H2,1-2H3/b13-8-InChIKey
IDBASKOJCGIVOH-JYRVWZFOSA-NSynonyms
CCOC(=O)C1=C2N(C(=C(C1C3=CC=CC=C3Cl)C#N)N)C(=O)C(=CC(=O)OC)S2
CCOC(=O)C1=c2sc(=CC(=O)OC)c(=O)n2C(=C(C1c1ccccc1Cl)C#N)N
ethyl(2Z)5amino7(2chlorophenyl)6cyano2(2methoxy2oxoethylidene)3oxo23dihydro7H(13)thiazolo(32a)pyridine8carboxylate
ethyl(2Z)5amino7(2chlorophenyl)6cyano2(2methoxy2oxoethylidene)3oxo7H(13)thiazolo(32a)pyridine8carboxylate
InChI=1SC20H16ClN3O5Sc132920(27)1615(10645712(10)21)11(922)17(23)2418(26)13(3019(16)24)814(25)282h4815H323H212H3b138
MFCD08273212
ZINC000008756198
ZINC000008756201
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