1-(4-butylphenyl)-5-oxidanylidene-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-butylphenyl)-5-oxidanylidene-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]pyrrolidine-3-carboxamide Openeye Name: 1-(4-butylphenyl)-5-oxo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]pyrrolidine-3-carboxamide CAS Name: 1-(4-butylphenyl)-5-oxo-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-butylphenyl)-5-oxo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]pyrrolidine-3-carboxamide Traditional Name: 1-(4-butylphenyl)-5-keto-N-[3-[4-(2-pyrimidyl)piperazino]propyl]pyrrolidine-3-carboxamide Formula: C26H36N6O2 MolecularWeight: 464.60304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C26H36N6O2/c1-2-3-6-21-7-9-23(10-8-21)32-20-22(19-24(32)33)25(34)27-13-5-14-30-15-17-31(18-16-30)26-28-11-4-12-29-26/h4,7-12,22H,2-3,5-6,13-20H2,1H3,(H,27,34)