4-(2,5-dimethylpyrrol-1-yl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Openeye Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]benzamide IUPAC Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]benzamide Formula: C24H30N6O MolecularWeight: 418.5346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)C

InChI

InChI=1S/C24H30N6O/c1-19-5-6-20(2)30(19)22-9-7-21(8-10-22)23(31)25-13-4-14-28-15-17-29(18-16-28)24-26-11-3-12-27-24/h3,5-12H,4,13-18H2,1-2H3,(H,25,31)