ethyl 1-[2-[2-(pyridin-3-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[2-(pyridin-3-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[2-(3-pyridylmethylcarbamoylamino)thiazol-4-yl]acetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-[2-[[oxo-(3-pyridinylmethylamino)methyl]amino]-4-thiazolyl]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[2-(pyridin-3-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[2-(3-pyridylmethylcarbamoylamino)thiazol-4-yl]acetyl]isonipecotic acid ethyl ester Formula: C20H25N5O4S MolecularWeight: 431.5086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CC2=CSC(=N2)NC(=O)NCC3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CC2=CSC(=N2)NC(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C20H25N5O4S/c1-2-29-18(27)15-5-8-25(9-6-15)17(26)10-16-13-30-20(23-16)24-19(28)22-12-14-4-3-7-21-11-14/h3-4,7,11,13,15H,2,5-6,8-10,12H2,1H3,(H2,22,23,24,28)