Vitas-M small molecule compound
ethyl N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-({[3-(trifluoromethyl)phenyl]carbonyl}amino)alaninate
Catalog ID
STK763458
SMILES CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C#N)CCCC2)NC(=O)c1cccc(c1)C(F)(F)F
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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 C22H19F6N3O3S MW 519.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19F6N3O3S/c1-2-34-19(33)20(22(26,27)28,30-17(32)12-6-5-7-13(10-12)21(23,24)25)31-18-15(11-29)14-8-3-4-9-16(14)35-18/h5-7,10,31H,2-4,8-9H2,1H3,(H,30,32)InChIKey
LZGUYJSAYHORJW-UHFFFAOYSA-NSynonyms
361368-21-0361368210
CCOC(=O)C(C(F)(F)F)(NC1=C(C2=C(S1)CCCC2)C#N)NC(=O)C3=CC(=CC=C3)C(F)(F)F
ethyl2((3cyano4567tetrahydro1benzothiophen2yl)amino)333trifluoro2((3(trifluoromethyl)benzoyl)amino)propanoate
ethyl2((3cyano4567tetrahydrobenzo(b)thiophen2yl)amino)333trifluoro2(3(trifluoromethyl)benzamido)propanoate
ethylN(3cyano4567tetrahydro1benzothiophen2yl)333trifluoro2(((3(trifluoromethyl)phenyl)carbonyl)amino)alaninate
InChI=1SC22H19F6N3O3Sc123419(33)20(22(2627)283017(32)1265713(1012)21(2324)25)311815(1129)14834916(14)3518h571031H2489H21H3(H3032)
MFCD01957173
ZINC000097950357
ZINC000097950358
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