ethyl (3S)-1-[2-oxidanylidene-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[2-oxidanylidene-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-oxo-2-[(4-phenylthiazol-2-yl)amino]ethyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-oxo-2-[(4-phenyl-2-thiazolyl)amino]ethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-keto-2-[(4-phenylthiazol-2-yl)amino]ethyl]nipecotic acid ethyl ester Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)CC(=O)NC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C19H23N3O3S/c1-2-25-18(24)15-9-6-10-22(11-15)12-17(23)21-19-20-16(13-26-19)14-7-4-3-5-8-14/h3-5,7-8,13,15H,2,6,9-12H2,1H3,(H,20,21,23)/t15-/m0/s1