5-(5-bromanyl-2-methoxy-phenyl)-N-(4-morpholin-4-ylphenyl)-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-(5-bromanyl-2-methoxy-phenyl)-N-(4-morpholin-4-ylphenyl)-1H-1,2,4-triazol-3-amine Openeye Name: 5-(5-bromo-2-methoxy-phenyl)-N-(4-morpholinophenyl)-1H-1,2,4-triazol-3-amine CAS Name: 5-(5-bromo-2-methoxyphenyl)-N-[4-(4-morpholinyl)phenyl]-1H-1,2,4-triazol-3-amine IUPAC Name: 5-(5-bromo-2-methoxyphenyl)-N-(4-morpholin-4-ylphenyl)-1H-1,2,4-triazol-3-amine Traditional Name: [5-(5-bromo-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]-(4-morpholinophenyl)amine Formula: C19H20BrN5O2 MolecularWeight: 430.2984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=NN2)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=NN2)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C19H20BrN5O2/c1-26-17-7-2-13(20)12-16(17)18-22-19(24-23-18)21-14-3-5-15(6-4-14)25-8-10-27-11-9-25/h2-7,12H,8-11H2,1H3,(H2,21,22,23,24)