N-(2-methoxyphenyl)-1-[2-oxidanylidene-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]piperidine-4-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-1-[2-oxidanylidene-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]piperidine-4-carboxamide Openeye Name: N-(2-methoxyphenyl)-1-[2-oxo-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]piperidine-4-carboxamide CAS Name: N-(2-methoxyphenyl)-1-[2-oxo-2-[2-[4-(1-pyrazolyl)phenyl]ethylamino]ethyl]-4-piperidinecarboxamide IUPAC Name: N-(2-methoxyphenyl)-1-[2-oxo-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]piperidine-4-carboxamide Traditional Name: 1-[2-keto-2-[2-(4-pyrazol-1-ylphenyl)ethylamino]ethyl]-N-(2-methoxyphenyl)isonipecotamide Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CCN(CC2)CC(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CCN(CC2)CC(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C26H31N5O3/c1-34-24-6-3-2-5-23(24)29-26(33)21-12-17-30(18-13-21)19-25(32)27-15-11-20-7-9-22(10-8-20)31-16-4-14-28-31/h2-10,14,16,21H,11-13,15,17-19H2,1H3,(H,27,32)(H,29,33)