2-[2-(pyridin-3-ylcarbonylamino)ethylcarbamoyl]quinazolin-4-olate

Systemtic Name: 2-[2-(pyridin-3-ylcarbonylamino)ethylcarbamoyl]quinazolin-4-olate Openeye Name: 2-[2-(pyridine-3-carbonylamino)ethylcarbamoyl]quinazolin-4-olate CAS Name: 2-[oxo-[2-[[oxo(3-pyridinyl)methyl]amino]ethylamino]methyl]-4-quinazolinolate IUPAC Name: 2-[2-(pyridine-3-carbonylamino)ethylcarbamoyl]quinazolin-4-olate Traditional Name: 2-(2-nicotinamidoethylcarbamoyl)quinazolin-4-olate Formula: C17H14N5O3- MolecularWeight: 336.32476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(=O)NCCNC(=O)C3=CN=CC=C3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(=O)NCCNC(=O)C3=CN=CC=C3)[O-]

InChI

InChI=1S/C17H15N5O3/c23-15(11-4-3-7-18-10-11)19-8-9-20-17(25)14-21-13-6-2-1-5-12(13)16(24)22-14/h1-7,10H,8-9H2,(H,19,23)(H,20,25)(H,21,22,24)/p-1