Vitas-M small molecule compound

ethyl 4-({[(2Z)-3-benzyl-4-oxo-2-(phenylimino)-1,3-thiazinan-6-yl]carbonyl}amino)benzoate

Catalog ID
STK765909
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N(/C(=N/c2ccccc2)/S1)Cc1ccccc1

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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 C27H25N3O4S MW 487.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O4S/c1-2-34-26(33)20-13-15-22(16-14-20)28-25(32)23-17-24(31)30(18-19-9-5-3-6-10-19)27(35-23)29-21-11-7-4-8-12-21/h3-16,23H,2,17-18H2,1H3,(H,28,32)/b29-27-
InChIKey
OYNKIOHSCFSAEM-OHYPFYFLSA-N
Synonyms

CCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N(C(=Nc2ccccc2)S1)Cc1ccccc1
ethyl4((((2Z)3benzyl4oxo2(phenylimino)13thiazinan6yl)carbonyl)amino)benzoate
MFCD02144544
ZINC000000710474
ZINC000008426775

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Available files

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