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

Systemtic Name: ethyl 4-[(2-chlorophenyl)methyl]-1-(1,2,5-thiadiazol-3-ylcarbonyl)piperidine-4-carboxylate Openeye Name: ethyl 4-[(2-chlorophenyl)methyl]-1-(1,2,5-thiadiazole-3-carbonyl)piperidine-4-carboxylate CAS Name: 4-[(2-chlorophenyl)methyl]-1-[oxo(1,2,5-thiadiazol-3-yl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-chlorophenyl)methyl]-1-(1,2,5-thiadiazole-3-carbonyl)piperidine-4-carboxylate Traditional Name: 4-(2-chlorobenzyl)-1-(1,2,5-thiadiazole-3-carbonyl)isonipecotic acid ethyl ester Formula: C18H20ClN3O3S MolecularWeight: 393.8877

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=NSN=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=NSN=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C18H20ClN3O3S/c1-2-25-17(24)18(11-13-5-3-4-6-14(13)19)7-9-22(10-8-18)16(23)15-12-20-26-21-15/h3-6,12H,2,7-11H2,1H3