Vitas-M small molecule compound
methyl (2Z)-[5-amino-6-cyano-8-(dimethylcarbamoyl)-7-(3-fluorophenyl)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridin-2(3H)-ylidene]ethanoate
Catalog ID
STL485327
SMILES COC(=O)/C=c/1\sc2=C(C(=O)N(C)C)C(C(=C(n2c1=O)N)C#N)c1cccc(c1)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 C20H17FN4O4S MW 428.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17FN4O4S/c1-24(2)19(28)16-15(10-5-4-6-11(21)7-10)12(9-22)17(23)25-18(27)13(30-20(16)25)8-14(26)29-3/h4-8,15H,23H2,1-3H3/b13-8-InChIKey
QVANPDMQXAKOJJ-JYRVWZFOSA-NSynonyms
CN(C)C(=O)C1=C2N(C(=C(C1C3=CC(=CC=C3)F)C#N)N)C(=O)C(=CC(=O)OC)S2
COC(=O)C=c1sc2=C(C(=O)N(C)C)C(C(=C(n2c1=O)N)C#N)c1cccc(c1)F
InChI=1SC20H17FN4O4Sc124(2)19(28)1615(1054611(21)710)12(922)17(23)2518(27)13(3020(16)25)814(26)293h4815H23H213H3b138
methyl(2Z)(5amino6cyano8(dimethylcarbamoyl)7(3fluorophenyl)3oxo7H(13)thiazolo(32a)pyridin2(3H)ylidene)ethanoate
methyl(2Z)2(5amino6cyano8(dimethylcarbamoyl)7(3fluorophenyl)3oxo7H(13)thiazolo(32a)pyridin2ylidene)acetate
MFCD08273196
ZINC000008756074
ZINC000008756077
Check stock
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