2-[1-(3-bromophenyl)-1,2,4-triazol-3-yl]-N-(1,2-oxazol-4-ylmethyl)aniline

Systemtic Name: 2-[1-(3-bromophenyl)-1,2,4-triazol-3-yl]-N-(1,2-oxazol-4-ylmethyl)aniline Openeye Name: 2-[1-(3-bromophenyl)-1,2,4-triazol-3-yl]-N-(isoxazol-4-ylmethyl)aniline CAS Name: 2-[1-(3-bromophenyl)-1,2,4-triazol-3-yl]-N-(4-isoxazolylmethyl)aniline IUPAC Name: 2-[1-(3-bromophenyl)-1,2,4-triazol-3-yl]-N-(1,2-oxazol-4-ylmethyl)aniline Traditional Name: [2-[1-(3-bromophenyl)-1,2,4-triazol-3-yl]phenyl]-(isoxazol-4-ylmethyl)amine Formula: C18H14BrN5O MolecularWeight: 396.24066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NN(C=N2)C3=CC(=CC=C3)Br)NCC4=CON=C4

Isomeric SMILES

C1=CC=C(C(=C1)C2=NN(C=N2)C3=CC(=CC=C3)Br)NCC4=CON=C4

InChI

InChI=1S/C18H14BrN5O/c19-14-4-3-5-15(8-14)24-12-21-18(23-24)16-6-1-2-7-17(16)20-9-13-10-22-25-11-13/h1-8,10-12,20H,9H2