Vitas-M small molecule compound
ethyl (E)-N-1,3-benzothiazol-2(3H)-ylidene-2-{[(3-chlorophenyl)carbonyl]amino}-3,3,3-trifluoroalaninate
Catalog ID
STK634371
SMILES CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccc(c1)Cl)/N=c\1/sc2c([nH]1)cccc2
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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 C19H15ClF3N3O3S MW 457.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClF3N3O3S/c1-2-29-16(28)18(19(21,22)23,25-15(27)11-6-5-7-12(20)10-11)26-17-24-13-8-3-4-9-14(13)30-17/h3-10H,2H2,1H3,(H,24,26)(H,25,27)InChIKey
YKVJJTZYVJOCKK-UHFFFAOYSA-NSynonyms
255714-73-9255714739
CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccc(c1)Cl)N=c1sc2c((nH)1)cccc2
CCOC(=O)C(C(F)(F)F)(NC1=NC2=CC=CC=C2S1)NC(=O)C3=CC(=CC=C3)Cl
ethyl(E)N13benzothiazol2(3H)ylidene2(((3chlorophenyl)carbonyl)amino)333trifluoroalaninate
ETHYL2(13BENZOTHIAZOL2YLAMINO)2((3CHLOROBENZOYL)AMINO)333TRIFLUOROPROPANOATE
InChI=1SC19H15ClF3N3O3Sc122916(28)18(19(2122)232515(27)1165712(20)1011)26172413834914(13)3017h310H2H21H3(H2426)(H2527)
MFCD18160368
ZINC000002314948
ZINC000002314949
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