4-[4-oxidanylidene-6-[(4-phenylpiperazin-1-yl)methyl]-1H-pyrimidin-2-yl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[4-oxidanylidene-6-[(4-phenylpiperazin-1-yl)methyl]-1H-pyrimidin-2-yl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]-1H-pyrimidin-2-yl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[4-oxo-6-[(4-phenyl-1-piperazinyl)methyl]-1H-pyrimidin-2-yl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]-1H-pyrimidin-2-yl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[4-keto-6-[(4-phenylpiperazino)methyl]-1H-pyrimidin-2-yl]-N-phenyl-piperazine-1-carboxamide Formula: C26H31N7O2 MolecularWeight: 473.57004

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)N=C(N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)N=C(N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H31N7O2/c34-24-19-22(20-30-11-13-31(14-12-30)23-9-5-2-6-10-23)27-25(29-24)32-15-17-33(18-16-32)26(35)28-21-7-3-1-4-8-21/h1-10,19H,11-18,20H2,(H,28,35)(H,27,29,34)