Vitas-M small molecule compound
methyl (2E)-2-[(3,4-dimethylphenyl)sulfonyl]-3-(phenylamino)prop-2-enoate
Catalog ID
STL133323
SMILES COC(=O)/C(=C\Nc1ccccc1)/S(=O)(=O)c1ccc(c(c1)C)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 C18H19NO4S MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4S/c1-13-9-10-16(11-14(13)2)24(21,22)17(18(20)23-3)12-19-15-7-5-4-6-8-15/h4-12,19H,1-3H3/b17-12+InChIKey
CVHILUGNLFKJHU-SFQUDFHCSA-NSynonyms
CC1=C(C=C(C=C1)S(=O)(=O)C(=CNC2=CC=CC=C2)C(=O)OC)C
COC(=O)C(=CNc1ccccc1)S(=O)(=O)c1ccc(c(c1)C)C
InChI=1SC18H19NO4Sc11391016(1114(13)2)24(2122)17(18(20)233)1219157546815h41219H13H3b1712+
methyl(2E)2((34dimethylphenyl)sulfonyl)3(phenylamino)prop2enoate
methyl(E)3anilino2(34dimethylphenyl)sulfonylprop2enoate
MFCD20753643
ZINC000067340515
ZINC67340515
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