4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(2-methylpropanoylamino)phenyl]benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(2-methylpropanoylamino)phenyl]benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(2-methylpropanoylamino)phenyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-[4-(2-methylpropanoylamino)phenyl]benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(isobutyrylamino)phenyl]benzamide Formula: C23H25N5O4 MolecularWeight: 435.4757

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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)NC(=O)C(C)C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H25N5O4/c1-14(2)22(29)24-19-9-11-20(12-10-19)25-23(30)18-7-5-17(6-8-18)13-27-16(4)21(28(31)32)15(3)26-27/h5-12,14H,13H2,1-4H3,(H,24,29)(H,25,30)