1-(2-tert-butylphenyl)-3-[4-[[4-(dimethylamino)quinolin-2-yl]amino]cyclohexyl]urea

Systemtic Name: 1-(2-tert-butylphenyl)-3-[4-[[4-(dimethylamino)quinolin-2-yl]amino]cyclohexyl]urea Openeye Name: 1-(2-tert-butylphenyl)-3-[4-[[4-(dimethylamino)-2-quinolyl]amino]cyclohexyl]urea CAS Name: 1-(2-tert-butylphenyl)-3-[4-[[4-(dimethylamino)-2-quinolinyl]amino]cyclohexyl]urea IUPAC Name: 1-(2-tert-butylphenyl)-3-[4-[[4-(dimethylamino)quinolin-2-yl]amino]cyclohexyl]urea Traditional Name: 1-(2-tert-butylphenyl)-3-[4-[[4-(dimethylamino)-2-quinolyl]amino]cyclohexyl]urea Formula: C28H37N5O MolecularWeight: 459.62628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC(=O)NC2CCC(CC2)NC3=NC4=CC=CC=C4C(=C3)N(C)C

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC(=O)NC2CCC(CC2)NC3=NC4=CC=CC=C4C(=C3)N(C)C

InChI

InChI=1S/C28H37N5O/c1-28(2,3)22-11-7-9-13-24(22)32-27(34)30-20-16-14-19(15-17-20)29-26-18-25(33(4)5)21-10-6-8-12-23(21)31-26/h6-13,18-20H,14-17H2,1-5H3,(H,29,31)(H2,30,32,34)