3-[2-[azanyl-[1-(2-cyclopropyl-2-oxidanylidene-ethyl)piperidin-4-yl]amino]ethanoyl]-1,3-thiazolidine-4-carbonitrile; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 3-[2-[azanyl-[1-(2-cyclopropyl-2-oxidanylidene-ethyl)piperidin-4-yl]amino]ethanoyl]-1,3-thiazolidine-4-carbonitrile; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 3-[2-[amino-[1-(2-cyclopropyl-2-oxo-ethyl)-4-piperidyl]amino]acetyl]thiazolidine-4-carbonitrile; 2,2,2-trifluoroacetic acid CAS Name: 3-[2-[amino-[1-(2-cyclopropyl-2-oxoethyl)-4-piperidinyl]amino]-1-oxoethyl]-4-thiazolidinecarbonitrile; 2,2,2-trifluoroacetic acid IUPAC Name: 3-[2-[amino-[1-(2-cyclopropyl-2-oxoethyl)piperidin-4-yl]amino]acetyl]-1,3-thiazolidine-4-carbonitrile; 2,2,2-trifluoroacetic acid Traditional Name: 3-[2-[amino-[1-(2-cyclopropyl-2-keto-ethyl)-4-piperidyl]amino]acetyl]thiazolidine-4-carbonitrile; 2,2,2-trifluoroacetic acid Formula: C20H27F6N5O6S MolecularWeight: 579.513699

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)CN2CCC(CC2)N(CC(=O)N3CSCC3C#N)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CC1C(=O)CN2CCC(CC2)N(CC(=O)N3CSCC3C#N)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C16H25N5O2S.2C2HF3O2/c17-7-14-10-24-11-20(14)16(23)9-21(18)13-3-5-19(6-4-13)8-15(22)12-1-2-12;2*3-2(4,5)1(6)7/h12-14H,1-6,8-11,18H2;2*(H,6,7)