ethyl 1-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(1-thiazol-2-ylpyrrol-2-yl)methyl]piperidine-4-carboxylate CAS Name: 1-[[1-(2-thiazolyl)-2-pyrrolyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[(1-thiazol-2-ylpyrrol-2-yl)methyl]isonipecotic acid ethyl ester Formula: C16H21N3O2S MolecularWeight: 319.42184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC2=CC=CN2C3=NC=CS3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC2=CC=CN2C3=NC=CS3

InChI

InChI=1S/C16H21N3O2S/c1-2-21-15(20)13-5-9-18(10-6-13)12-14-4-3-8-19(14)16-17-7-11-22-16/h3-4,7-8,11,13H,2,5-6,9-10,12H2,1H3