Vitas-M small molecule compound

(2E)-3-(3-{[(2,4,6-trimethylphenyl)sulfonyl]amino}phenyl)prop-2-enoic acid

Catalog ID
STK539019
SMILES OC(=O)/C=C/c1cccc(c1)NS(=O)(=O)c1c(C)cc(cc1C)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/c1-12-9-13(2)18(14(3)10-12)24(22,23)19-16-6-4-5-15(11-16)7-8-17(20)21/h4-11,19H,1-3H3,(H,20,21)/b8-7+
InChIKey
MKFZMVNUDTUTER-BQYQJAHWSA-N
Synonyms
1164499-38-0
(2E)3(3(((246trimethylphenyl)sulfonyl)amino)phenyl)prop2enoicacid
(E)3(3((246TRIMETHYLPHENYL)SULFONYLAMINO)PHENYL)2PROPENOICACID
(E)3(3((246TRIMETHYLPHENYL)SULFONYLAMINO)PHENYL)PROP2ENOICACID
(E)3(3(246trimethylphenylsulfonamido)phenyl)acrylicacid
(E)3(3(MESITYLSULFONYLAMINO)PHENYL)ACRYLICACID
1164499380
3(3(246TRIMETHYLBENZENESULFONYLAMINO)PHENYL)ACRYLICACID
CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2=CC=CC(=C2)C=CC(=O)O)C
InChI=1SC18H19NO4Sc112913(2)18(14(3)1012)24(2223)191664515(1116)7817(20)21h41119H13H3(H2021)b87+
MFCD00539994
OC(=O)C=Cc1cccc(c1)NS(=O)(=O)c1c(C)cc(cc1C)C
ZINC000000046730
ZINC46730

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Available files

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