Vitas-M small molecule compound
ethyl (2E)-4-{[(2,5-dimethoxyphenyl)carbamothioyl]amino}-4-oxobut-2-enoate
Catalog ID
STL062502
SMILES CCOC(=O)/C=C/C(=O)NC(=S)Nc1cc(OC)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 C15H18N2O5S MW 338.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O5S/c1-4-22-14(19)8-7-13(18)17-15(23)16-11-9-10(20-2)5-6-12(11)21-3/h5-9H,4H2,1-3H3,(H2,16,17,18,23)/b8-7+InChIKey
ZRMBNHGGHAUBIJ-BQYQJAHWSA-NSynonyms
CCOC(=O)C=CC(=O)NC(=S)NC1=C(C=CC(=C1)OC)OC
CCOC(=O)C=CC(=O)NC(=S)Nc1cc(OC)ccc1OC
ethyl(2E)4(((25dimethoxyphenyl)carbamothioyl)amino)4oxobut2enoate
ETHYL(E)4((25DIMETHOXYPHENYL)CARBAMOTHIOYLAMINO)4OXOBUT2ENOATE
InChI=1SC15H18N2O5Sc142214(19)8713(18)1715(23)1611910(202)5612(11)213h59H4H213H3(H216171823)b87+
MFCD03586929
ZINC000002551749
ZINC02551749
ZINC2551749
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