ethyl 1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxylate CAS Name: 1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxylate Traditional Name: 1-[3-(4-fluorobenzyl)-1,2,4-thiadiazol-5-yl]nipecotic acid ethyl ester Formula: C17H20FN3O2S MolecularWeight: 349.423003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=NC(=NS2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=NC(=NS2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C17H20FN3O2S/c1-2-23-16(22)13-4-3-9-21(11-13)17-19-15(20-24-17)10-12-5-7-14(18)8-6-12/h5-8,13H,2-4,9-11H2,1H3