Vitas-M small molecule compound

methyl 4-{[(2Z)-6-({4-[chloro(difluoro)methoxy]phenyl}carbamoyl)-3-methyl-4-oxo-1,3-thiazinan-2-ylidene]amino}benzoate

Catalog ID
STK732384
SMILES COC(=O)c1ccc(cc1)/N=C/1\SC(CC(=O)N1C)C(=O)Nc1ccc(cc1)OC(Cl)(F)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 C21H18ClF2N3O5S MW 497.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClF2N3O5S/c1-27-17(28)11-16(18(29)25-13-7-9-15(10-8-13)32-21(22,23)24)33-20(27)26-14-5-3-12(4-6-14)19(30)31-2/h3-10,16H,11H2,1-2H3,(H,25,29)/b26-20-
InChIKey
KHKQCIFWWRTALX-QOMWVZHYSA-N
Synonyms

COC(=O)c1ccc(cc1)N=C1SC(CC(=O)N1C)C(=O)Nc1ccc(cc1)OC(Cl)(F)F
methyl4(((2Z)6((4(chloro(difluoro)methoxy)phenyl)carbamoyl)3methyl4oxo13thiazinan2ylidene)amino)benzoate
MFCD03056867
ZINC000012417039
ZINC000012417042

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Available files

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