1-butyl-2-(4-methoxyphenyl)-6-oxidanylidene-N-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-butyl-2-(4-methoxyphenyl)-6-oxidanylidene-N-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxamide Openeye Name: 1-butyl-2-(4-methoxyphenyl)-6-oxo-N-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxamide CAS Name: 1-butyl-2-(4-methoxyphenyl)-6-oxo-N-[(1-phenyl-4-pyrazolyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-butyl-2-(4-methoxyphenyl)-6-oxo-N-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxamide Traditional Name: 1-butyl-6-keto-2-(4-methoxyphenyl)-N-[(1-phenylpyrazol-4-yl)methyl]nipecotamide Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCN1C(C(CCC1=O)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H32N4O3/c1-3-4-16-30-25(32)15-14-24(26(30)21-10-12-23(34-2)13-11-21)27(33)28-17-20-18-29-31(19-20)22-8-6-5-7-9-22/h5-13,18-19,24,26H,3-4,14-17H2,1-2H3,(H,28,33)