3-[2-(4-bromophenyl)-5-methyl-1,2,3-triazol-4-yl]-2-morpholin-4-yl-propanenitrile

Systemtic Name: 3-[2-(4-bromophenyl)-5-methyl-1,2,3-triazol-4-yl]-2-morpholin-4-yl-propanenitrile Openeye Name: 3-[2-(4-bromophenyl)-5-methyl-triazol-4-yl]-2-morpholino-propanenitrile CAS Name: 3-[2-(4-bromophenyl)-5-methyl-4-triazolyl]-2-(4-morpholinyl)propanenitrile IUPAC Name: 3-[2-(4-bromophenyl)-5-methyltriazol-4-yl]-2-morpholin-4-ylpropanenitrile Traditional Name: 3-[2-(4-bromophenyl)-5-methyl-triazol-4-yl]-2-morpholino-propionitrile Formula: C16H18BrN5O MolecularWeight: 376.25102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1CC(C#N)N2CCOCC2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=NN(N=C1CC(C#N)N2CCOCC2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H18BrN5O/c1-12-16(10-15(11-18)21-6-8-23-9-7-21)20-22(19-12)14-4-2-13(17)3-5-14/h2-5,15H,6-10H2,1H3