Vitas-M small molecule compound
ethyl (2Z)-5-amino-6-cyano-2-(2-methoxy-2-oxoethylidene)-7-(3-methoxyphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Catalog ID
STL485344
SMILES CCOC(=O)C1=c2s/c(=C\C(=O)OC)/c(=O)n2C(=C(C1c1cccc(c1)OC)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 C21H19N3O6S MW 441.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O6S/c1-4-30-21(27)17-16(11-6-5-7-12(8-11)28-2)13(10-22)18(23)24-19(26)14(31-20(17)24)9-15(25)29-3/h5-9,16H,4,23H2,1-3H3/b14-9-InChIKey
AMKFGSQHXAFNRS-ZROIWOOFSA-NSynonyms
CCOC(=O)C1=C2N(C(=C(C1C3=CC(=CC=C3)OC)C#N)N)C(=O)C(=CC(=O)OC)S2
CCOC(=O)C1=c2sc(=CC(=O)OC)c(=O)n2C(=C(C1c1cccc(c1)OC)C#N)N
ethyl(2Z)5amino6cyano2(2methoxy2oxoethylidene)7(3methoxyphenyl)3oxo23dihydro7H(13)thiazolo(32a)pyridine8carboxylate
ethyl(2Z)5amino6cyano2(2methoxy2oxoethylidene)7(3methoxyphenyl)3oxo7H(13)thiazolo(32a)pyridine8carboxylate
InChI=1SC21H19N3O6Sc143021(27)1716(1165712(811)282)13(1022)18(23)2419(26)14(3120(17)24)915(25)293h5916H423H213H3b149
MFCD08273208
ZINC000033431922
ZINC000033431925
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