N-[4-[[3-[(2S)-2-azanyl-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxidanylidene-propyl]-1H-indol-5-yl]oxy]phenyl]-1,3-thiazolidine-4-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-[4-[[3-[(2S)-2-azanyl-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxidanylidene-propyl]-1H-indol-5-yl]oxy]phenyl]-1,3-thiazolidine-4-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-[4-[[3-[(2S)-2-amino-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxo-propyl]-1H-indol-5-yl]oxy]phenyl]thiazolidine-4-carboxamide; 2,2,2-trifluoroacetic acid CAS Name: N-[4-[[3-[(2S)-2-amino-3-[(2S)-2-cyano-1-pyrrolidinyl]-3-oxopropyl]-1H-indol-5-yl]oxy]phenyl]-4-thiazolidinecarboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-[4-[[3-[(2S)-2-amino-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxopropyl]-1H-indol-5-yl]oxy]phenyl]-1,3-thiazolidine-4-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: N-[4-[[3-[(2S)-2-amino-3-[(2S)-2-cyanopyrrolidino]-3-keto-propyl]-1H-indol-5-yl]oxy]phenyl]thiazolidine-4-carboxamide; 2,2,2-trifluoroacetic acid Formula: C28H29F3N6O5S MolecularWeight: 618.62727

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CNC3=C2C=C(C=C3)OC4=CC=C(C=C4)NC(=O)C5CSCN5)N)C#N.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@H](CC2=CNC3=C2C=C(C=C3)OC4=CC=C(C=C4)NC(=O)C5CSCN5)N)C#N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C26H28N6O3S.C2HF3O2/c27-12-18-2-1-9-32(18)26(34)22(28)10-16-13-29-23-8-7-20(11-21(16)23)35-19-5-3-17(4-6-19)31-25(33)24-14-36-15-30-24;3-2(4,5)1(6)7/h3-8,11,13,18,22,24,29-30H,1-2,9-10,14-15,28H2,(H,31,33);(H,6,7)/t18-,22-,24?;/m0./s1