N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanamide

Systemtic Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]ethanamide Openeye Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetamide CAS Name: N-[3-(2-methyl-4-pyrimidinyl)phenyl]-2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]acetamide IUPAC Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]acetamide Traditional Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetamide Formula: C28H22N6O3 MolecularWeight: 490.51268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C28H22N6O3/c1-19-29-15-14-26(30-19)21-6-5-7-23(16-21)31-27(35)17-22-18-33(24-8-3-2-4-9-24)32-28(22)20-10-12-25(13-11-20)34(36)37/h2-16,18H,17H2,1H3,(H,31,35)