ethyl 4-[(1-phenylcyclopropyl)carbonyl-(1,3-thiazol-2-ylmethyl)amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(1-phenylcyclopropyl)carbonyl-(1,3-thiazol-2-ylmethyl)amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(1-phenylcyclopropanecarbonyl)-(thiazol-2-ylmethyl)amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-(1-phenylcyclopropyl)methyl]-(2-thiazolylmethyl)amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1-phenylcyclopropanecarbonyl)-(1,3-thiazol-2-ylmethyl)amino]piperidine-1-carboxylate Traditional Name: 4-[(1-phenylcyclopropanecarbonyl)-(thiazol-2-ylmethyl)amino]piperidine-1-carboxylic acid ethyl ester Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N(CC2=NC=CS2)C(=O)C3(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N(CC2=NC=CS2)C(=O)C3(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H27N3O3S/c1-2-28-21(27)24-13-8-18(9-14-24)25(16-19-23-12-15-29-19)20(26)22(10-11-22)17-6-4-3-5-7-17/h3-7,12,15,18H,2,8-11,13-14,16H2,1H3