N4-(3-bromophenyl)-6-morpholin-4-yl-N2-[(E)-1-phenylethylideneamino]-1,3,5-triazine-2,4-diamine

Systemtic Name: N4-(3-bromophenyl)-6-morpholin-4-yl-N2-[(E)-1-phenylethylideneamino]-1,3,5-triazine-2,4-diamine Openeye Name: N4-(3-bromophenyl)-6-morpholino-N2-[(E)-1-phenylethylideneamino]-1,3,5-triazine-2,4-diamine CAS Name: N4-(3-bromophenyl)-6-(4-morpholinyl)-N2-[(E)-1-phenylethylideneamino]-1,3,5-triazine-2,4-diamine IUPAC Name: 4-N-(3-bromophenyl)-6-morpholin-4-yl-2-N-[(E)-1-phenylethylideneamino]-1,3,5-triazine-2,4-diamine Traditional Name: [4-(3-bromoanilino)-6-morpholino-s-triazin-2-yl]-[(E)-1-phenylethylideneamino]amine Formula: C21H22BrN7O MolecularWeight: 468.34968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC(=NC(=N1)NC2=CC(=CC=C2)Br)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C/C(=N\NC1=NC(=NC(=N1)NC2=CC(=CC=C2)Br)N3CCOCC3)/C4=CC=CC=C4

InChI

InChI=1S/C21H22BrN7O/c1-15(16-6-3-2-4-7-16)27-28-20-24-19(23-18-9-5-8-17(22)14-18)25-21(26-20)29-10-12-30-13-11-29/h2-9,14H,10-13H2,1H3,(H2,23,24,25,26,28)/b27-15+