N,N-dimethyl-4-[6-methyl-5-[(4-nitrophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N,N-dimethyl-4-[6-methyl-5-[(4-nitrophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N,N-dimethyl-4-[6-methyl-5-[(4-nitrophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N,N-dimethyl-4-[6-methyl-5-[(4-nitrophenyl)methyl]-2-phenyl-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N,N-dimethyl-4-[6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N,N-dimethyl-4-[6-methyl-5-(4-nitrobenzyl)-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide Formula: C25H28N6O3 MolecularWeight: 460.52822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)N(C)C)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)N(C)C)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H28N6O3/c1-18-22(17-19-9-11-21(12-10-19)31(33)34)24(27-23(26-18)20-7-5-4-6-8-20)29-13-15-30(16-14-29)25(32)28(2)3/h4-12H,13-17H2,1-3H3