Vitas-M small molecule compound

methyl 4-{[4-(3,4-dimethylphenyl)-5-methyl-1,3-thiazol-2-yl]amino}benzoate

Catalog ID
STK066778
SMILES COC(=O)c1ccc(cc1)Nc1sc(c(n1)c1ccc(c(c1)C)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 C20H20N2O2S MW 352.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O2S/c1-12-5-6-16(11-13(12)2)18-14(3)25-20(22-18)21-17-9-7-15(8-10-17)19(23)24-4/h5-11H,1-4H3,(H,21,22)
InChIKey
GYTBNRHYZCTSKA-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C2=C(SC(=N2)NC3=CC=C(C=C3)C(=O)OC)C)C
COC(=O)c1ccc(cc1)Nc1sc(c(n1)c1ccc(c(c1)C)C)C
InChI=1SC20H20N2O2Sc1125616(1113(12)2)1814(3)2520(2218)21179715(81017)19(23)244h511H14H3(H2122)
METHYL4((4(34DIMETHYLPHENYL)5METHYL13THIAZOL2YL)AMINO)BENZOATE
MFCD02274597
STK066778
ZINC000000845835
ZINC00845835
ZINC845835

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Available files

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