N-(5-bromanylpyridin-2-yl)-2-[(4-carbamimidoylphenyl)carbonylamino]-4,5-dimethoxy-benzamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-[(4-carbamimidoylphenyl)carbonylamino]-4,5-dimethoxy-benzamide Openeye Name: N-(5-bromo-2-pyridyl)-2-[(4-carbamimidoylbenzoyl)amino]-4,5-dimethoxy-benzamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-4,5-dimethoxybenzamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-[(4-carbamimidoylbenzoyl)amino]-4,5-dimethoxybenzamide Traditional Name: 2-[(4-amidinobenzoyl)amino]-N-(5-bromo-2-pyridyl)-4,5-dimethoxy-benzamide Formula: C22H20BrN5O4 MolecularWeight: 498.3293

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=NC=C(C=C2)Br)NC(=O)C3=CC=C(C=C3)C(=N)N)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=NC=C(C=C2)Br)NC(=O)C3=CC=C(C=C3)C(=N)N)OC

InChI

InChI=1S/C22H20BrN5O4/c1-31-17-9-15(22(30)28-19-8-7-14(23)11-26-19)16(10-18(17)32-2)27-21(29)13-5-3-12(4-6-13)20(24)25/h3-11H,1-2H3,(H3,24,25)(H,27,29)(H,26,28,30)