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

Systemtic Name: N2-[(E)-(5-bromanyl-2-methoxy-phenyl)methylideneamino]-6-morpholin-4-yl-N4-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: N2-[(E)-(5-bromo-2-methoxy-phenyl)methyleneamino]-6-morpholino-N4-phenyl-1,3,5-triazine-2,4-diamine CAS Name: N2-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-6-(4-morpholinyl)-N4-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-[(E)-(5-bromo-2-methoxyphenyl)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)-(5-bromo-2-methoxy-benzylidene)amino]amine Formula: C21H22BrN7O2 MolecularWeight: 484.34908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=NNC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=N/NC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C21H22BrN7O2/c1-30-18-8-7-16(22)13-15(18)14-23-28-20-25-19(24-17-5-3-2-4-6-17)26-21(27-20)29-9-11-31-12-10-29/h2-8,13-14H,9-12H2,1H3,(H2,24,25,26,27,28)/b23-14+