5-azanyl-1-[(3-bromanyl-4-methoxy-phenyl)methyl]-N-[(4-methylphenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[(3-bromanyl-4-methoxy-phenyl)methyl]-N-[(4-methylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[(3-bromo-4-methoxy-phenyl)methyl]-N-(p-tolylmethyl)triazole-4-carboxamide CAS Name: 5-amino-1-[(3-bromo-4-methoxyphenyl)methyl]-N-[(4-methylphenyl)methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-[(3-bromo-4-methoxyphenyl)methyl]-N-[(4-methylphenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-1-(3-bromo-4-methoxy-benzyl)-N-(4-methylbenzyl)triazole-4-carboxamide Formula: C19H20BrN5O2 MolecularWeight: 430.2984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=C(N(N=N2)CC3=CC(=C(C=C3)OC)Br)N

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=C(N(N=N2)CC3=CC(=C(C=C3)OC)Br)N

InChI

InChI=1S/C19H20BrN5O2/c1-12-3-5-13(6-4-12)10-22-19(26)17-18(21)25(24-23-17)11-14-7-8-16(27-2)15(20)9-14/h3-9H,10-11,21H2,1-2H3,(H,22,26)