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

Systemtic Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-5-nitro-furan-2-carboxamide CAS Name: N-[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-5-nitro-2-furamide Formula: C21H24N6O4 MolecularWeight: 424.45306

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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)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H24N6O4/c1-26(2)19-15-5-3-4-6-16(15)24-21(25-19)23-14-9-7-13(8-10-14)22-20(28)17-11-12-18(31-17)27(29)30/h3-6,11-14H,7-10H2,1-2H3,(H,22,28)(H,23,24,25)