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

Systemtic Name: N2-[(E)-(3-bromophenyl)methylideneamino]-6-morpholin-4-yl-N4-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: N2-[(E)-(3-bromophenyl)methyleneamino]-6-morpholino-N4-phenyl-1,3,5-triazine-2,4-diamine CAS Name: N2-[(E)-(3-bromophenyl)methylideneamino]-6-(4-morpholinyl)-N4-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-[(E)-(3-bromophenyl)methylideneamino]-6-morpholin-4-yl-4-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: (4-anilino-6-morpholino-s-triazin-2-yl)-[(E)-(3-bromobenzylidene)amino]amine Formula: C20H20BrN7O MolecularWeight: 454.3231

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC(=N2)NN=CC3=CC(=CC=C3)Br)NC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=NC(=NC(=N2)N/N=C/C3=CC(=CC=C3)Br)NC4=CC=CC=C4

InChI

InChI=1S/C20H20BrN7O/c21-16-6-4-5-15(13-16)14-22-27-19-24-18(23-17-7-2-1-3-8-17)25-20(26-19)28-9-11-29-12-10-28/h1-8,13-14H,9-12H2,(H2,23,24,25,26,27)/b22-14+