4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(4-pyridylmethyl)phenyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(4-pyridylmethyl)phenyl]benzamide Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C25H23N5O3/c1-17-24(30(32)33)18(2)29(28-17)16-21-3-7-22(8-4-21)25(31)27-23-9-5-19(6-10-23)15-20-11-13-26-14-12-20/h3-14H,15-16H2,1-2H3,(H,27,31)