ethyl 4-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)amino]benzoate

Systemtic Name: ethyl 4-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)amino]benzoate Openeye Name: ethyl 4-[(4-anilino-6-morpholino-1,3,5-triazin-2-yl)amino]benzoate CAS Name: 4-[[4-anilino-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-anilino-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]benzoate Traditional Name: 4-[(4-anilino-6-morpholino-s-triazin-2-yl)amino]benzoic acid ethyl ester Formula: C22H24N6O3 MolecularWeight: 420.46436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C22H24N6O3/c1-2-31-19(29)16-8-10-18(11-9-16)24-21-25-20(23-17-6-4-3-5-7-17)26-22(27-21)28-12-14-30-15-13-28/h3-11H,2,12-15H2,1H3,(H2,23,24,25,26,27)