5-(3-bromophenyl)-N-(4-morpholin-4-ylphenyl)-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-(3-bromophenyl)-N-(4-morpholin-4-ylphenyl)-1H-1,2,4-triazol-3-amine Openeye Name: 5-(3-bromophenyl)-N-(4-morpholinophenyl)-1H-1,2,4-triazol-3-amine CAS Name: 5-(3-bromophenyl)-N-[4-(4-morpholinyl)phenyl]-1H-1,2,4-triazol-3-amine IUPAC Name: 5-(3-bromophenyl)-N-(4-morpholin-4-ylphenyl)-1H-1,2,4-triazol-3-amine Traditional Name: [5-(3-bromophenyl)-1H-1,2,4-triazol-3-yl]-(4-morpholinophenyl)amine Formula: C18H18BrN5O MolecularWeight: 400.27242

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=NNC(=N3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=NNC(=N3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C18H18BrN5O/c19-14-3-1-2-13(12-14)17-21-18(23-22-17)20-15-4-6-16(7-5-15)24-8-10-25-11-9-24/h1-7,12H,8-11H2,(H2,20,21,22,23)