(E)-N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]-3-(2-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-nitrophenyl)acrylamide Formula: C25H28N6O3 MolecularWeight: 460.52822

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=CC=CC=C21)NC3CCC(CC3)NC(=O)C=CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C25H28N6O3/c1-30(2)24-20-8-4-5-9-21(20)28-25(29-24)27-19-14-12-18(13-15-19)26-23(32)16-11-17-7-3-6-10-22(17)31(33)34/h3-11,16,18-19H,12-15H2,1-2H3,(H,26,32)(H,27,28,29)/b16-11+