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

Systemtic Name: 4-[(2-chlorophenyl)methylamino]-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-nitro-benzamide Openeye Name: 4-[(2-chlorophenyl)methylamino]-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-nitro-benzamide CAS Name: 4-[(2-chlorophenyl)methylamino]-N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-nitrobenzamide IUPAC Name: 4-[(2-chlorophenyl)methylamino]-N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-nitrobenzamide Traditional Name: 4-[(2-chlorobenzyl)amino]-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-nitro-benzamide Formula: C25H22ClN5O3 MolecularWeight: 475.92688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H22ClN5O3/c1-16-24(17(2)30(29-16)20-9-4-3-5-10-20)28-25(32)18-12-13-22(23(14-18)31(33)34)27-15-19-8-6-7-11-21(19)26/h3-14,27H,15H2,1-2H3,(H,28,32)