Vitas-M small molecule compound
methyl N-[(4-chlorophenyl)carbonyl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-3,3,3-trifluoroalaninate
Catalog ID
STK536586
SMILES CCOc1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccc(cc1)Cl
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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 C20H17ClF3N3O4S MW 487.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClF3N3O4S/c1-3-31-13-8-9-14-15(10-13)32-18(25-14)27-19(17(29)30-2,20(22,23)24)26-16(28)11-4-6-12(21)7-5-11/h4-10H,3H2,1-2H3,(H,25,27)(H,26,28)InChIKey
CXEJTNSTEGKKBY-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)N=C(S2)NC(C(=O)OC)(C(F)(F)F)NC(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H17ClF3N3O4Sc133113891415(1013)3218(2514)2719(17(29)30220(2223)24)2616(28)114612(21)7511h410H3H212H3(H2527)(H2628)
METHYL2((4CHLOROBENZOYL)AMINO)2((6ETHOXY13BENZOTHIAZOL2YL)AMINO)333TRIFLUOROPROPANOATE
methyl2(4chlorobenzamido)2((6ethoxybenzo(d)thiazol2yl)amino)333trifluoropropanoate
methylN((4chlorophenyl)carbonyl)2((6ethoxy13benzothiazol2yl)amino)333trifluoroalaninate
MFCD02934177
ZINC000008969591
ZINC000008969592
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