methyl 1-[2-(3-morpholin-4-ylcarbonyl-5-thiophen-2-yl-pyrazol-1-yl)ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(3-morpholin-4-ylcarbonyl-5-thiophen-2-yl-pyrazol-1-yl)ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[3-(morpholine-4-carbonyl)-5-(2-thienyl)pyrazol-1-yl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[3-[4-morpholinyl(oxo)methyl]-5-thiophen-2-yl-1-pyrazolyl]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[3-(morpholine-4-carbonyl)-5-thiophen-2-ylpyrazol-1-yl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[3-(morpholine-4-carbonyl)-5-(2-thienyl)pyrazol-1-yl]acetyl]isonipecotic acid methyl ester Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CN2C(=CC(=N2)C(=O)N3CCOCC3)C4=CC=CS4

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CN2C(=CC(=N2)C(=O)N3CCOCC3)C4=CC=CS4

InChI

InChI=1S/C21H26N4O5S/c1-29-21(28)15-4-6-23(7-5-15)19(26)14-25-17(18-3-2-12-31-18)13-16(22-25)20(27)24-8-10-30-11-9-24/h2-3,12-13,15H,4-11,14H2,1H3