4-azanyl-N-[4-[(2-azanylquinolin-6-yl)carbonylamino]phenyl]-2-methyl-quinoline-6-carboxamide

Systemtic Name: 4-azanyl-N-[4-[(2-azanylquinolin-6-yl)carbonylamino]phenyl]-2-methyl-quinoline-6-carboxamide Openeye Name: 4-amino-N-[4-[(2-aminoquinoline-6-carbonyl)amino]phenyl]-2-methyl-quinoline-6-carboxamide CAS Name: 4-amino-N-[4-[[(2-amino-6-quinolinyl)-oxomethyl]amino]phenyl]-2-methyl-6-quinolinecarboxamide IUPAC Name: 4-amino-N-[4-[(2-aminoquinoline-6-carbonyl)amino]phenyl]-2-methylquinoline-6-carboxamide Traditional Name: 4-amino-N-[4-[(2-aminoquinoline-6-carbonyl)amino]phenyl]-2-methyl-quinoline-6-carboxamide Formula: C27H22N6O2 MolecularWeight: 462.50258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)N=C(C=C5)N)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)N=C(C=C5)N)C(=C1)N

InChI

InChI=1S/C27H22N6O2/c1-15-12-22(28)21-14-18(3-10-24(21)30-15)27(35)32-20-7-5-19(6-8-20)31-26(34)17-2-9-23-16(13-17)4-11-25(29)33-23/h2-14H,1H3,(H2,28,30)(H2,29,33)(H,31,34)(H,32,35)