Vitas-M small molecule compound
methyl (2E)-2-[(4-methylphenyl)sulfonyl]-3-(pyridin-2-ylamino)prop-2-enoate
Catalog ID
STL133317
SMILES COC(=O)/C(=C\Nc1ccccn1)/S(=O)(=O)c1ccc(cc1)C
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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 C16H16N2O4S MW 332.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O4S/c1-12-6-8-13(9-7-12)23(20,21)14(16(19)22-2)11-18-15-5-3-4-10-17-15/h3-11H,1-2H3,(H,17,18)/b14-11+InChIKey
ZSNDTONHFLFDHI-SDNWHVSQSA-NSynonyms
CC1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC=CC=N2)C(=O)OC
COC(=O)C(=CNc1ccccn1)S(=O)(=O)c1ccc(cc1)C
InChI=1SC16H16N2O4Sc1126813(9712)23(2021)14(16(19)222)111815534101715h311H12H3(H1718)b1411+
methyl(2E)2((4methylphenyl)sulfonyl)3(pyridin2ylamino)prop2enoate
methyl(E)2(4methylphenyl)sulfonyl3(pyridin2ylamino)prop2enoate
MFCD20753637
ZINC000102921969
ZINC102921969
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