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

Systemtic Name: (4-methylpiperazin-1-yl)-[4-(4-nitrophenyl)-2-pyridin-4-yl-pyrimidin-5-yl]methanone Openeye Name: (4-methylpiperazin-1-yl)-[4-(4-nitrophenyl)-2-(4-pyridyl)pyrimidin-5-yl]methanone CAS Name: (4-methyl-1-piperazinyl)-[4-(4-nitrophenyl)-2-pyridin-4-yl-5-pyrimidinyl]methanone IUPAC Name: (4-methylpiperazin-1-yl)-[4-(4-nitrophenyl)-2-pyridin-4-ylpyrimidin-5-yl]methanone Traditional Name: (4-methylpiperazino)-[4-(4-nitrophenyl)-2-(4-pyridyl)pyrimidin-5-yl]methanone Formula: C21H20N6O3 MolecularWeight: 404.4219

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CN=C(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=NC=C4

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CN=C(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=NC=C4

InChI

InChI=1S/C21H20N6O3/c1-25-10-12-26(13-11-25)21(28)18-14-23-20(16-6-8-22-9-7-16)24-19(18)15-2-4-17(5-3-15)27(29)30/h2-9,14H,10-13H2,1H3