Vitas-M small molecule compound

(2Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-2-(phenylimino)-1,3-thiazinane-6-carboxamide

Catalog ID
STK110830
SMILES COc1cc(CCN2C(=O)CC(S/C/2=N\c2ccccc2)C(=O)Nc2ccc(cc2)F)ccc1OC

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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 C27H26FN3O4S MW 507.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26FN3O4S/c1-34-22-13-8-18(16-23(22)35-2)14-15-31-25(32)17-24(26(33)29-21-11-9-19(28)10-12-21)36-27(31)30-20-6-4-3-5-7-20/h3-13,16,24H,14-15,17H2,1-2H3,(H,29,33)/b30-27-
InChIKey
FERWVVCVMVTXAJ-IKPAITLHSA-N
Synonyms
405902-44-5
(2Z)3(2(34dimethoxyphenyl)ethyl)N(4fluorophenyl)4oxo2(phenylimino)13thiazinane6carboxamide
(Z)3(34dimethoxyphenethyl)N(4fluorophenyl)4oxo2(phenylimino)13thiazinane6carboxamide
405902445
COc1cc(CCN2C(=O)CC(SC2=Nc2ccccc2)C(=O)Nc2ccc(cc2)F)ccc1OC
MFCD02144064
ZINC000009432063
ZINC000012468278

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Available files

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