Vitas-M small molecule compound

5,5-bis(hydroxymethyl)-2-[(3-methylphenyl)amino]-1,3-thiazol-4(5H)-one

Catalog ID
STK045643
SMILES OCC1(CO)SC(=NC1=O)Nc1cccc(c1)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 C12H14N2O3S MW 266.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O3S/c1-8-3-2-4-9(5-8)13-11-14-10(17)12(6-15,7-16)18-11/h2-5,15-16H,6-7H2,1H3,(H,13,14,17)
InChIKey
VSQAGMMFXYTRTR-UHFFFAOYSA-N
Synonyms
488801-90-7
488801907
55BIS(HYDROXYMETHYL)2((3METHYLPHENYL)AMINO)13THIAZOL4(5H)ONE
55BIS(HYDROXYMETHYL)2(3METHYLANILINO)13THIAZOL4ONE
55bis(hydroxymethyl)2(mtolylamino)thiazol4(5H)one
55BISHYDROXYMETHYL2MTOLYLAMINOTHIAZOL4ONE
CC1=CC(=CC=C1)NC2=NC(=O)C(S2)(CO)CO
InChI=1SC12H14N2O3Sc183249(58)13111410(17)12(615716)1811h251516H67H21H3(H131417)
MFCD03043769
OCC1(CO)SC(=NC1=O)Nc1cccc(c1)C
STK045643
ZINC000000375795
ZINC375795

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Available files

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