1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(4-phenoxyphenyl)urea

Systemtic Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(4-phenoxyphenyl)urea Openeye Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(4-phenoxyphenyl)urea CAS Name: 1-[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]-3-(4-phenoxyphenyl)urea IUPAC Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(4-phenoxyphenyl)urea Traditional Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(4-phenoxyphenyl)urea Formula: C29H32N6O2 MolecularWeight: 496.60338

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=CC=CC=C21)NC3CCC(CC3)NC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CN(C)C1=NC(=NC2=CC=CC=C21)NC3CCC(CC3)NC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H32N6O2/c1-35(2)27-25-10-6-7-11-26(25)33-28(34-27)30-20-12-14-21(15-13-20)31-29(36)32-22-16-18-24(19-17-22)37-23-8-4-3-5-9-23/h3-11,16-21H,12-15H2,1-2H3,(H,30,33,34)(H2,31,32,36)