Vitas-M small molecule compound

ethyl 4-({(2Z)-6-[(3-chlorophenyl)carbamoyl]-3-ethyl-4-oxo-1,3-thiazinan-2-ylidene}amino)benzoate

Catalog ID
STK112257
SMILES CCOC(=O)c1ccc(cc1)/N=C/1\SC(CC(=O)N1CC)C(=O)Nc1cccc(c1)Cl

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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 C22H22ClN3O4S MW 459.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O4S/c1-3-26-19(27)13-18(20(28)24-17-7-5-6-15(23)12-17)31-22(26)25-16-10-8-14(9-11-16)21(29)30-4-2/h5-12,18H,3-4,13H2,1-2H3,(H,24,28)/b25-22-
InChIKey
FMZOGSLPCRUBGW-LVWGJNHUSA-N
Synonyms

CCOC(=O)c1ccc(cc1)N=C1SC(CC(=O)N1CC)C(=O)Nc1cccc(c1)Cl
ethyl4(((2Z)6((3chlorophenyl)carbamoyl)3ethyl4oxo13thiazinan2ylidene)amino)benzoate
MFCD02146759
ZINC000009763431
ZINC000009763432

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.