2-[(4-methoxyphenyl)amino]-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 2-[(4-methoxyphenyl)amino]-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Openeye Name: 2-(4-methoxyanilino)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide CAS Name: 2-(4-methoxyanilino)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]benzamide IUPAC Name: 2-(4-methoxyanilino)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Traditional Name: 2-(p-anisidino)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]benzamide Formula: C25H30N6O2 MolecularWeight: 446.5447

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=CC=CC=C2C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=CC=CC=C2C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C25H30N6O2/c1-33-21-10-8-20(9-11-21)29-23-7-3-2-6-22(23)24(32)26-14-5-15-30-16-18-31(19-17-30)25-27-12-4-13-28-25/h2-4,6-13,29H,5,14-19H2,1H3,(H,26,32)