N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-5-(3-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-5-(3-nitrophenyl)-2-furamide Formula: C27H28N6O4 MolecularWeight: 500.54902

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=CC=CC=C21)NC3CCC(CC3)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=NC(=NC2=CC=CC=C21)NC3CCC(CC3)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H28N6O4/c1-32(2)25-21-8-3-4-9-22(21)30-27(31-25)29-19-12-10-18(11-13-19)28-26(34)24-15-14-23(37-24)17-6-5-7-20(16-17)33(35)36/h3-9,14-16,18-19H,10-13H2,1-2H3,(H,28,34)(H,29,30,31)