ethyl 3-(3-phenylpropyl)-1-(1,3-thiazol-2-ylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl 3-(3-phenylpropyl)-1-(1,3-thiazol-2-ylmethyl)piperidine-3-carboxylate Openeye Name: ethyl 3-(3-phenylpropyl)-1-(thiazol-2-ylmethyl)piperidine-3-carboxylate CAS Name: 3-(3-phenylpropyl)-1-(2-thiazolylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-phenylpropyl)-1-(1,3-thiazol-2-ylmethyl)piperidine-3-carboxylate Traditional Name: 3-(3-phenylpropyl)-1-(thiazol-2-ylmethyl)nipecotic acid ethyl ester Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)CC2=NC=CS2)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)CC2=NC=CS2)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H28N2O2S/c1-2-25-20(24)21(11-6-10-18-8-4-3-5-9-18)12-7-14-23(17-21)16-19-22-13-15-26-19/h3-5,8-9,13,15H,2,6-7,10-12,14,16-17H2,1H3