Vitas-M small molecule compound

ethyl 2-{[(4-tert-butylphenyl)carbonyl](propyl)amino}-4-methyl-1,3-thiazole-5-carboxylate

Catalog ID
STK314952
SMILES CCCN(C(=O)c1ccc(cc1)C(C)(C)C)c1nc(c(s1)C(=O)OCC)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 C21H28N2O3S MW 388.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O3S/c1-7-13-23(20-22-14(3)17(27-20)19(25)26-8-2)18(24)15-9-11-16(12-10-15)21(4,5)6/h9-12H,7-8,13H2,1-6H3
InChIKey
OIXXAHCIVUZPOD-UHFFFAOYSA-N
Synonyms
938009-28-0
938009280
CCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)C2=CC=C(C=C2)C(C)(C)C
ethyl2(((4tertbutylphenyl)carbonyl)(propyl)amino)4methyl13thiazole5carboxylate
ethyl2((4tertbutylbenzoyl)propylamino)4methyl13thiazole5carboxylate
InChI=1SC21H28N2O3Sc171323(202214(3)17(2720)19(25)2682)18(24)1591116(121015)21(45)6h912H7813H216H3
MFCD08553791
ZINC000013961245
ZINC13961245

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Available files

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