Vitas-M small molecule compound
ethyl 4-{[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-6-(phenylcarbamoyl)-1,3-thiazinan-2-ylidene]amino}benzoate
Catalog ID
STL018906
SMILES CCOC(=O)c1ccc(cc1)/N=C/1\SC(CC(=O)N1Cc1ccc2c(c1)OCO2)C(=O)Nc1ccccc1
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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 C28H25N3O6S MW 531.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O6S/c1-2-35-27(34)19-9-11-21(12-10-19)30-28-31(16-18-8-13-22-23(14-18)37-17-36-22)25(32)15-24(38-28)26(33)29-20-6-4-3-5-7-20/h3-14,24H,2,15-17H2,1H3,(H,29,33)/b30-28-InChIKey
KRBOXIBMWJLNTL-HYOGKJQXSA-NSynonyms
522650-17-5(Z)ethyl4((3(benzo(d)(13)dioxol5ylmethyl)4oxo6(phenylcarbamoyl)13thiazinan2ylidene)amino)benzoate
522650175
CCOC(=O)c1ccc(cc1)N=C1SC(CC(=O)N1Cc1ccc2c(c1)OCO2)C(=O)Nc1ccccc1
ethyl4(((2Z)3(13benzodioxol5ylmethyl)4oxo6(phenylcarbamoyl)13thiazinan2ylidene)amino)benzoate
MFCD03487381
ZINC000100824333
ZINC000100824337
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