(4-methylpiperazin-1-yl)-[4-[(4-nitrophenyl)methyl]-2-phenyl-pyrimidin-5-yl]methanone

Systemtic Name: (4-methylpiperazin-1-yl)-[4-[(4-nitrophenyl)methyl]-2-phenyl-pyrimidin-5-yl]methanone Openeye Name: (4-methylpiperazin-1-yl)-[4-[(4-nitrophenyl)methyl]-2-phenyl-pyrimidin-5-yl]methanone CAS Name: (4-methyl-1-piperazinyl)-[4-[(4-nitrophenyl)methyl]-2-phenyl-5-pyrimidinyl]methanone IUPAC Name: (4-methylpiperazin-1-yl)-[4-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-5-yl]methanone Traditional Name: (4-methylpiperazino)-[4-(4-nitrobenzyl)-2-phenyl-pyrimidin-5-yl]methanone Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CN=C(N=C2CC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CN=C(N=C2CC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H23N5O3/c1-26-11-13-27(14-12-26)23(29)20-16-24-22(18-5-3-2-4-6-18)25-21(20)15-17-7-9-19(10-8-17)28(30)31/h2-10,16H,11-15H2,1H3