Vitas-M small molecule compound

methyl (2E)-3-[(4-methylphenyl)amino]-2-[(4-methylphenyl)sulfonyl]prop-2-enoate

Catalog ID
STL133314
SMILES COC(=O)/C(=C\Nc1ccc(cc1)C)/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 C18H19NO4S MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4S/c1-13-4-8-15(9-5-13)19-12-17(18(20)23-3)24(21,22)16-10-6-14(2)7-11-16/h4-12,19H,1-3H3/b17-12+
InChIKey
DLPCIBHUNJMKHY-SFQUDFHCSA-N
Synonyms

CC1=CC=C(C=C1)NC=C(C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)C
COC(=O)C(=CNc1ccc(cc1)C)S(=O)(=O)c1ccc(cc1)C
InChI=1SC18H19NO4Sc1134815(9513)191217(18(20)233)24(2122)1610614(2)71116h41219H13H3b1712+
methyl(2E)3((4methylphenyl)amino)2((4methylphenyl)sulfonyl)prop2enoate
methyl(E)3(4methylanilino)2(4methylphenyl)sulfonylprop2enoate
MFCD20753634
ZINC000067340496
ZINC67340496

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.