N-[3-[methyl(phenyl)amino]propyl]-2-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-cyclohexane-1-carboxamide

Systemtic Name: N-[3-[methyl(phenyl)amino]propyl]-2-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-cyclohexane-1-carboxamide Openeye Name: N-[3-(N-methylanilino)propyl]-2-[4-(2-pyridyl)piperazine-1-carbonyl]cyclohexanecarboxamide CAS Name: N-[3-(N-methylanilino)propyl]-2-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-[3-(N-methylanilino)propyl]-2-(4-pyridin-2-ylpiperazine-1-carbonyl)cyclohexane-1-carboxamide Traditional Name: N-[3-(N-methylanilino)propyl]-2-[4-(2-pyridyl)piperazine-1-carbonyl]cyclohexanecarboxamide Formula: C27H37N5O2 MolecularWeight: 463.61498

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1CCCCC1C(=O)N2CCN(CC2)C3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CN(CCCNC(=O)C1CCCCC1C(=O)N2CCN(CC2)C3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C27H37N5O2/c1-30(22-10-3-2-4-11-22)17-9-16-29-26(33)23-12-5-6-13-24(23)27(34)32-20-18-31(19-21-32)25-14-7-8-15-28-25/h2-4,7-8,10-11,14-15,23-24H,5-6,9,12-13,16-21H2,1H3,(H,29,33)