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

Systemtic Name: N-[3-(diethylamino)propyl]-1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonyl-piperidine-3-carboxamide Openeye Name: N-[3-(diethylamino)propyl]-1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]piperidine-3-carboxamide CAS Name: N-[3-(diethylamino)propyl]-1-[[1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(diethylamino)propyl]-1-[1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carbonyl]piperidine-3-carboxamide Traditional Name: N-[3-(diethylamino)propyl]-1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]nipecotamide Formula: C27H35FN6O2 MolecularWeight: 494.604203

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4

Isomeric SMILES

CCN(CC)CCCNC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4

InChI

InChI=1S/C27H35FN6O2/c1-3-31(4-2)15-8-14-29-25(35)21-9-7-18-33(20-21)27(36)24-19-30-34(23-12-10-22(28)11-13-23)26(24)32-16-5-6-17-32/h5-6,10-13,16-17,19,21H,3-4,7-9,14-15,18,20H2,1-2H3,(H,29,35)