4-(4-cyclopentylpiperazin-4-ium-1-yl)-4-oxidanylidene-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 4-(4-cyclopentylpiperazin-4-ium-1-yl)-4-oxidanylidene-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 4-(4-cyclopentylpiperazin-4-ium-1-yl)-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 4-(4-cyclopentyl-1-piperazin-4-iumyl)-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 4-(4-cyclopentylpiperazin-4-ium-1-yl)-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 4-(4-cyclopentylpiperazin-4-ium-1-yl)-4-keto-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butyramide Formula: C16H23F3N5O2S+ MolecularWeight: 406.44633

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(CC2)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F

InChI

InChI=1S/C16H22F3N5O2S/c17-16(18,19)14-21-22-15(27-14)20-12(25)5-6-13(26)24-9-7-23(8-10-24)11-3-1-2-4-11/h11H,1-10H2,(H,20,22,25)/p+1