Vitas-M small molecule compound

methyl 3,3,3-trifluoro-N-(furan-2-ylcarbonyl)-2-[(4-methyl-1,3-benzothiazol-2-yl)amino]alaninate

Catalog ID
STK547705
SMILES COC(=O)C(C(F)(F)F)(NC(=O)c1ccco1)Nc1nc2c(s1)cccc2C

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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 C17H14F3N3O4S MW 413.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14F3N3O4S/c1-9-5-3-7-11-12(9)21-15(28-11)23-16(14(25)26-2,17(18,19)20)22-13(24)10-6-4-8-27-10/h3-8H,1-2H3,(H,21,23)(H,22,24)
InChIKey
ZQGVRGAMWIKYIS-UHFFFAOYSA-N
Synonyms
489419-48-9
(S)methyl333trifluoro2(furan2carboxamido)2((4methylbenzo(d)thiazol2yl)amino)propanoate
489419489
CC1=C2C(=CC=C1)SC(=N2)NC(C(=O)OC)(C(F)(F)F)NC(=O)C3=CC=CO3
InChI=1SC17H14F3N3O4Sc195371112(9)2115(2811)2316(14(25)26217(1819)20)2213(24)106482710h38H12H3(H2123)(H2224)
METHYL333TRIFLUORO2((FURAN2YLCARBONYL)AMINO)N(4METHYL13BENZOTHIAZOL2YL)DALANINATE
METHYL333TRIFLUORO2((FURAN2YLCARBONYL)AMINO)N(4METHYL13BENZOTHIAZOL2YL)LALANINATE
METHYL333TRIFLUORO2(2FUROYLAMINO)2((4METHYL13BENZOTHIAZOL2YL)AMINO)PROPANOATE
METHYL333TRIFLUORO2(FURAN2CARBONYLAMINO)2((4METHYL13BENZOTHIAZOL2YL)AMINO)PROPANOATE
methyl333trifluoroN(furan2ylcarbonyl)2((4methyl13benzothiazol2yl)amino)alaninate
MFCD03067252
ZINC000009111419
ZINC000009111420

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Available files

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