Vitas-M small molecule compound
methyl 2-(acetylamino)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoroalaninate
Catalog ID
STK763262
SMILES N#Cc1c(sc2c1CCCC2)NC(C(F)(F)F)(C(=O)OC)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 C15H16F3N3O3S MW 375.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16F3N3O3S/c1-8(22)20-14(13(23)24-2,15(16,17)18)21-12-10(7-19)9-5-3-4-6-11(9)25-12/h21H,3-6H2,1-2H3,(H,20,22)InChIKey
DSMCVJNGBHTKCU-UHFFFAOYSA-NSynonyms
CC(=O)NC(C(=O)OC)(C(F)(F)F)NC1=C(C2=C(S1)CCCC2)C#N
InChI=1SC15H16F3N3O3Sc18(22)2014(13(23)24215(1617)18)211210(719)9534611(9)2512h21H36H212H3(H2022)
methyl2(acetylamino)N(3cyano4567tetrahydro1benzothiophen2yl)333trifluoroalaninate
methyl2acetamido2((3cyano4567tetrahydro1benzothiophen2yl)amino)333trifluoropropanoate
MFCD02642866
ZINC000004548666
ZINC000004548669
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