N-[3-(diethylamino)propyl]-1-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[3-(diethylamino)propyl]-1-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]piperidine-4-carboxamide Openeye Name: N-[3-(diethylamino)propyl]-1-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]piperidine-4-carboxamide CAS Name: N-[3-(diethylamino)propyl]-1-[[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(diethylamino)propyl]-1-[(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methyl]piperidine-4-carboxamide Traditional Name: N-[3-(diethylamino)propyl]-1-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]isonipecotamide Formula: C27H38N6O MolecularWeight: 462.63022

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)C1CCN(CC1)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CCN(CC)CCCNC(=O)C1CCN(CC1)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C27H38N6O/c1-3-30(4-2)16-10-15-28-26(34)23-13-19-31(20-14-23)22-24-21-29-33(25-11-6-5-7-12-25)27(24)32-17-8-9-18-32/h5-9,11-12,17-18,21,23H,3-4,10,13-16,19-20,22H2,1-2H3,(H,28,34)