N-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]-2-(4-methylpiperazin-1-yl)ethanamide

Systemtic Name: N-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]-2-(4-methylpiperazin-1-yl)ethanamide Openeye Name: N-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]-2-(4-methylpiperazin-1-yl)acetamide CAS Name: N-[4-methyl-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinyl]-2-(4-methyl-1-piperazinyl)acetamide IUPAC Name: N-[4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidin-5-yl]-2-(4-methylpiperazin-1-yl)acetamide Traditional Name: N-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]-2-(4-methylpiperazino)acetamide Formula: C24H26N6O3 MolecularWeight: 446.50164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1NC(=O)CN2CCN(CC2)C)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=NC(=C1NC(=O)CN2CCN(CC2)C)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H26N6O3/c1-17-22(26-21(31)16-29-13-11-28(2)12-14-29)23(19-9-6-10-20(15-19)30(32)33)27-24(25-17)18-7-4-3-5-8-18/h3-10,15H,11-14,16H2,1-2H3,(H,26,31)