3-[2-[azanyl-(4-methylcyclohexyl)amino]ethanoyl]-1,1-bis(oxidanylidene)-1,3-thiazolidine-4-carbonitrile; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 3-[2-[azanyl-(4-methylcyclohexyl)amino]ethanoyl]-1,1-bis(oxidanylidene)-1,3-thiazolidine-4-carbonitrile; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 3-[2-[amino-(4-methylcyclohexyl)amino]acetyl]-1,1-dioxo-1,3-thiazolidine-4-carbonitrile; 2,2,2-trifluoroacetic acid CAS Name: 3-[2-[amino-(4-methylcyclohexyl)amino]-1-oxoethyl]-1,1-dioxo-1,3-thiazolidine-4-carbonitrile; 2,2,2-trifluoroacetic acid IUPAC Name: 3-[2-[amino-(4-methylcyclohexyl)amino]acetyl]-1,1-dioxo-1,3-thiazolidine-4-carbonitrile; 2,2,2-trifluoroacetic acid Traditional Name: 3-[2-[amino-(4-methylcyclohexyl)amino]acetyl]-1,1-diketo-1,3-thiazolidine-4-carbonitrile; 2,2,2-trifluoroacetic acid Formula: C15H23F3N4O5S MolecularWeight: 428.42713

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N(CC(=O)N2CS(=O)(=O)CC2C#N)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1CCC(CC1)N(CC(=O)N2CS(=O)(=O)CC2C#N)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C13H22N4O3S.C2HF3O2/c1-10-2-4-11(5-3-10)17(15)7-13(18)16-9-21(19,20)8-12(16)6-14;3-2(4,5)1(6)7/h10-12H,2-5,7-9,15H2,1H3;(H,6,7)