ethyl 3-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]carbamoylamino]benzoate

Systemtic Name: ethyl 3-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]carbamoylamino]benzoate Openeye Name: ethyl 3-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]carbamoylamino]benzoate CAS Name: 3-[[[[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]carbamoylamino]benzoate Traditional Name: 3-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]carbamoylamino]benzoic acid ethyl ester Formula: C26H32N6O3 MolecularWeight: 476.57068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)NC2CCC(CC2)NC3=NC4=CC=CC=C4C(=N3)N(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)NC2CCC(CC2)NC3=NC4=CC=CC=C4C(=N3)N(C)C

InChI

InChI=1S/C26H32N6O3/c1-4-35-24(33)17-8-7-9-20(16-17)29-26(34)28-19-14-12-18(13-15-19)27-25-30-22-11-6-5-10-21(22)23(31-25)32(2)3/h5-11,16,18-19H,4,12-15H2,1-3H3,(H,27,30,31)(H2,28,29,34)