2-[3-(quinolin-2-ylcarbonylamino)propylcarbamoyl]quinazolin-4-olate

Systemtic Name: 2-[3-(quinolin-2-ylcarbonylamino)propylcarbamoyl]quinazolin-4-olate Openeye Name: 2-[3-(quinoline-2-carbonylamino)propylcarbamoyl]quinazolin-4-olate CAS Name: 2-[oxo-[3-[[oxo(2-quinolinyl)methyl]amino]propylamino]methyl]-4-quinazolinolate IUPAC Name: 2-[3-(quinoline-2-carbonylamino)propylcarbamoyl]quinazolin-4-olate Traditional Name: 2-[3-(quinaldoylamino)propylcarbamoyl]quinazolin-4-olate Formula: C22H18N5O3- MolecularWeight: 400.41002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCCCNC(=O)C3=NC4=CC=CC=C4C(=N3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCCCNC(=O)C3=NC4=CC=CC=C4C(=N3)[O-]

InChI

InChI=1S/C22H19N5O3/c28-20-15-7-2-4-9-17(15)26-19(27-20)22(30)24-13-5-12-23-21(29)18-11-10-14-6-1-3-8-16(14)25-18/h1-4,6-11H,5,12-13H2,(H,23,29)(H,24,30)(H,26,27,28)/p-1