4-bromanyl-3-methyl-N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]aniline

Systemtic Name: 4-bromanyl-3-methyl-N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]aniline Openeye Name: 4-bromo-3-methyl-N-[(2-phenyltriazol-4-yl)methyl]aniline CAS Name: 4-bromo-3-methyl-N-[(2-phenyl-4-triazolyl)methyl]aniline IUPAC Name: 4-bromo-3-methyl-N-[(2-phenyltriazol-4-yl)methyl]aniline Traditional Name: (4-bromo-3-methyl-phenyl)-[(2-phenyltriazol-4-yl)methyl]amine Formula: C16H15BrN4 MolecularWeight: 343.2211

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NCC2=NN(N=C2)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NCC2=NN(N=C2)C3=CC=CC=C3)Br

InChI

InChI=1S/C16H15BrN4/c1-12-9-13(7-8-16(12)17)18-10-14-11-19-21(20-14)15-5-3-2-4-6-15/h2-9,11,18H,10H2,1H3