Vitas-M small molecule compound

(2E)-3-{3-[(3-hydroxypropyl)sulfamoyl]-4-methylphenyl}prop-2-enoic acid

Catalog ID
STK806877
SMILES OCCCNS(=O)(=O)c1cc(/C=C/C(=O)O)ccc1C

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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 C13H17NO5S MW 299.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO5S/c1-10-3-4-11(5-6-13(16)17)9-12(10)20(18,19)14-7-2-8-15/h3-6,9,14-15H,2,7-8H2,1H3,(H,16,17)/b6-5+
InChIKey
LTHDEOLHQDOWDP-AATRIKPKSA-N
Synonyms
1164523-41-4
(2E)3(3(((3HYDROXYPROPYL)AMINO)SULFONYL)4METHYLPHENYL)PROP2ENOICACID
(2E)3(3((3hydroxypropyl)sulfamoyl)4methylphenyl)prop2enoicacid
(E)3(3(3HYDROXYPROPYLSULFAMOYL)4METHYLPHENYL)PROP2ENOICACID
(E)3(3(N(3hydroxypropyl)sulfamoyl)4methylphenyl)acrylicacid
1164523414
3(3(((3HYDROXYPROPYL)AMINO)SULFONYL)4METHYLPHENYL)ACRYLICACID
CC1=C(C=C(C=C1)C=CC(=O)O)S(=O)(=O)NCCCO
InChI=1SC13H17NO5Sc1103411(5613(16)17)912(10)20(1819)1472815h3691415H278H21H3(H1617)b65+
MFCD02659568
OCCCNS(=O)(=O)c1cc(C=CC(=O)O)ccc1C
ZINC000001816334
ZINC1816334

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Available files

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