Vitas-M small molecule compound
methyl 2-(acetylamino)-3,3,3-trifluoro-N-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]alaninate
Catalog ID
STK543958
SMILES COC(=O)C(C(F)(F)F)(Nc1nc2c(s1)cc(cc2)C(C)C)NC(=O)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 C16H18F3N3O3S MW 389.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18F3N3O3S/c1-8(2)10-5-6-11-12(7-10)26-14(20-11)22-15(13(24)25-4,16(17,18)19)21-9(3)23/h5-8H,1-4H3,(H,20,22)(H,21,23)InChIKey
ICORAWOTXYMUIN-UHFFFAOYSA-NSynonyms
487023-41-6(S)methyl2acetamido333trifluoro2((6isopropylbenzo(d)thiazol2yl)amino)propanoate
2ACETYLAMINO333TRIFLUORO2(6ISOPROPYLBENZOTHIAZOL2YLAMINO)PROPIONICACIDMETHYLESTER
487023416
CC(C)C1=CC2=C(C=C1)N=C(S2)NC(C(=O)OC)(C(F)(F)F)NC(=O)C
InChI=1SC16H18F3N3O3Sc18(2)10561112(710)2614(2011)2215(13(24)25416(1718)19)219(3)23h58H14H3(H2022)(H2123)
METHYL2(ACETYLAMINO)333TRIFLUORON(6(1METHYLETHYL)13BENZOTHIAZOL2YL)ALANINATE
methyl2(acetylamino)333trifluoroN(6(propan2yl)13benzothiazol2yl)alaninate
METHYL2ACETAMIDO333TRIFLUORO2((6PROPAN2YL13BENZOTHIAZOL2YL)AMINO)PROPANOATE
MFCD03067343
ZINC000009012918
ZINC000009012919
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