methyl 2-[[2-(pyridin-4-ylmethylamino)pyridin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[2-(pyridin-4-ylmethylamino)pyridin-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[2-(4-pyridylmethylamino)pyridine-3-carbonyl]amino]benzoate CAS Name: 2-[[oxo-[2-(pyridin-4-ylmethylamino)-3-pyridinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(pyridin-4-ylmethylamino)pyridine-3-carbonyl]amino]benzoate Traditional Name: 2-[[2-(4-pyridylmethylamino)nicotinoyl]amino]benzoic acid methyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=C(N=CC=C2)NCC3=CC=NC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=C(N=CC=C2)NCC3=CC=NC=C3

InChI

InChI=1S/C20H18N4O3/c1-27-20(26)15-5-2-3-7-17(15)24-19(25)16-6-4-10-22-18(16)23-13-14-8-11-21-12-9-14/h2-12H,13H2,1H3,(H,22,23)(H,24,25)