ethyl 4-(3-phenylpropyl)-1-(1,2,3-thiadiazol-4-ylcarbonyl)piperidine-4-carboxylate

Systemtic Name: ethyl 4-(3-phenylpropyl)-1-(1,2,3-thiadiazol-4-ylcarbonyl)piperidine-4-carboxylate Openeye Name: ethyl 4-(3-phenylpropyl)-1-(thiadiazole-4-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo(4-thiadiazolyl)methyl]-4-(3-phenylpropyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-phenylpropyl)-1-(thiadiazole-4-carbonyl)piperidine-4-carboxylate Traditional Name: 4-(3-phenylpropyl)-1-(thiadiazole-4-carbonyl)isonipecotic acid ethyl ester Formula: C20H25N3O3S MolecularWeight: 387.4958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=CSN=N2)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=CSN=N2)CCCC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O3S/c1-2-26-19(25)20(10-6-9-16-7-4-3-5-8-16)11-13-23(14-12-20)18(24)17-15-27-22-21-17/h3-5,7-8,15H,2,6,9-14H2,1H3