N-(2-azanylpyridin-3-yl)-4-[[(4-nitrophenyl)methylcarbamoylamino]methyl]benzamide

Systemtic Name: N-(2-azanylpyridin-3-yl)-4-[[(4-nitrophenyl)methylcarbamoylamino]methyl]benzamide Openeye Name: N-(2-amino-3-pyridyl)-4-[[(4-nitrophenyl)methylcarbamoylamino]methyl]benzamide CAS Name: N-(2-amino-3-pyridinyl)-4-[[[[(4-nitrophenyl)methylamino]-oxomethyl]amino]methyl]benzamide IUPAC Name: N-(2-aminopyridin-3-yl)-4-[[(4-nitrophenyl)methylcarbamoylamino]methyl]benzamide Traditional Name: N-(2-amino-3-pyridyl)-4-[[(4-nitrobenzyl)carbamoylamino]methyl]benzamide Formula: C21H20N6O4 MolecularWeight: 420.4213

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)N)NC(=O)C2=CC=C(C=C2)CNC(=O)NCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)N)NC(=O)C2=CC=C(C=C2)CNC(=O)NCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O4/c22-19-18(2-1-11-23-19)26-20(28)16-7-3-14(4-8-16)12-24-21(29)25-13-15-5-9-17(10-6-15)27(30)31/h1-11H,12-13H2,(H2,22,23)(H,26,28)(H2,24,25,29)