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

Systemtic Name: ethyl 1-[[2-[(4-ethoxyphenyl)amino]-1,3-thiazol-4-yl]carbonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-ethoxyanilino)thiazole-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[2-(4-ethoxyanilino)-4-thiazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-ethoxyanilino)-1,3-thiazole-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[2-(p-phenetidino)thiazole-4-carbonyl]isonipecotic acid ethyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)N3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)N3CCC(CC3)C(=O)OCC

InChI

InChI=1S/C20H25N3O4S/c1-3-26-16-7-5-15(6-8-16)21-20-22-17(13-28-20)18(24)23-11-9-14(10-12-23)19(25)27-4-2/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,21,22)