4-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide

Systemtic Name: 4-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide Openeye Name: 4-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide CAS Name: 4-methyl-N-[2-(4-methyl-1-piperazinyl)ethyl]-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxamide IUPAC Name: 4-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-6-(3-nitrophenyl)-2-phenylpyrimidine-5-carboxamide Traditional Name: 4-methyl-N-[2-(4-methylpiperazino)ethyl]-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxamide Formula: C25H28N6O3 MolecularWeight: 460.52822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)NCCN2CCN(CC2)C)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)NCCN2CCN(CC2)C)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C25H28N6O3/c1-18-22(25(32)26-11-12-30-15-13-29(2)14-16-30)23(20-9-6-10-21(17-20)31(33)34)28-24(27-18)19-7-4-3-5-8-19/h3-10,17H,11-16H2,1-2H3,(H,26,32)