Vitas-M small molecule compound
ethyl 4-{[(2Z)-3-benzyl-6-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-4-oxo-1,3-thiazinan-2-ylidene]amino}benzoate
Catalog ID
STK662825
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N(/C(=N/c2ccc(cc2)C(=O)OCC)/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 C30H29N3O6S MW 559.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O6S/c1-3-38-28(36)21-10-14-23(15-11-21)31-27(35)25-18-26(34)33(19-20-8-6-5-7-9-20)30(40-25)32-24-16-12-22(13-17-24)29(37)39-4-2/h5-17,25H,3-4,18-19H2,1-2H3,(H,31,35)/b32-30-InChIKey
GBRKHMRUBPRBCJ-GCUVURNUSA-NSynonyms
(Z)ethyl4(3benzyl2((4(ethoxycarbonyl)phenyl)imino)4oxo13thiazinane6carboxamido)benzoate
CCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N(C(=Nc2ccc(cc2)C(=O)OCC)S1)Cc1ccccc1
ethyl4(((2Z)3benzyl6((4(ethoxycarbonyl)phenyl)carbamoyl)4oxo13thiazinan2ylidene)amino)benzoate
MFCD02146110
ZINC000097968599
ZINC000097968600
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