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

Systemtic Name: ethyl 1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]piperidine-3-carboxylate CAS Name: 1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxylate Traditional Name: 1-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]nipecotic acid ethyl ester Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O2S/c1-3-23-17(22)15-5-4-10-21(12-15)18-19-16(20-24-18)11-14-8-6-13(2)7-9-14/h6-9,15H,3-5,10-12H2,1-2H3