3-nitro-4-[(phenylmethyl)amino]-N-[(1-phenylpyrazol-4-yl)methyl]benzamide

Systemtic Name: 3-nitro-4-[(phenylmethyl)amino]-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Openeye Name: 4-(benzylamino)-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide CAS Name: 3-nitro-4-[(phenylmethyl)amino]-N-[(1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 4-(benzylamino)-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: 4-(benzylamino)-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Formula: C24H21N5O3 MolecularWeight: 427.45524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)C(=O)NCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)C(=O)NCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N5O3/c30-24(26-15-19-16-27-28(17-19)21-9-5-2-6-10-21)20-11-12-22(23(13-20)29(31)32)25-14-18-7-3-1-4-8-18/h1-13,16-17,25H,14-15H2,(H,26,30)