Vitas-M small molecule compound
ethyl 3,3,3-trifluoro-2-(pentanoylamino)-N-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]alaninate
Catalog ID
STK548152
SMILES CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1nc2c(s1)cc(cc2)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 C20H26F3N3O3S MW 445.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26F3N3O3S/c1-5-7-8-16(27)25-19(20(21,22)23,17(28)29-6-2)26-18-24-14-10-9-13(12(3)4)11-15(14)30-18/h9-12H,5-8H2,1-4H3,(H,24,26)(H,25,27)InChIKey
WZSMTVPDEFDDAI-UHFFFAOYSA-NSynonyms
488705-96-0(S)ethyl333trifluoro2((6isopropylbenzo(d)thiazol2yl)amino)2pentanamidopropanoate
488705960
CCCCC(=O)NC(C(=O)OCC)(C(F)(F)F)NC1=NC2=C(S1)C=C(C=C2)C(C)C
ETHYL333TRIFLUORO2(PENTANOYLAMINO)2((6PROPAN2YL13BENZOTHIAZOL2YL)AMINO)PROPANOATE
ethyl333trifluoro2(pentanoylamino)N(6(propan2yl)13benzothiazol2yl)alaninate
InChI=1SC20H26F3N3O3Sc157816(27)2519(20(2122)2317(28)2962)2618241410913(12(3)4)1115(14)3018h912H58H214H3(H2426)(H2527)
MFCD03067338
ZINC000009090013
ZINC000009090014
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