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

Systemtic Name: 5-azanyl-N-(2-bromanyl-4-methyl-phenyl)-1-[(2-methylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-(2-bromo-4-methyl-phenyl)-1-(o-tolylmethyl)triazole-4-carboxamide CAS Name: 5-amino-N-(2-bromo-4-methylphenyl)-1-[(2-methylphenyl)methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-(2-bromo-4-methylphenyl)-1-[(2-methylphenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-N-(2-bromo-4-methyl-phenyl)-1-(2-methylbenzyl)triazole-4-carboxamide Formula: C18H18BrN5O MolecularWeight: 400.27242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(N(N=N2)CC3=CC=CC=C3C)N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(N(N=N2)CC3=CC=CC=C3C)N)Br

InChI

InChI=1S/C18H18BrN5O/c1-11-7-8-15(14(19)9-11)21-18(25)16-17(20)24(23-22-16)10-13-6-4-3-5-12(13)2/h3-9H,10,20H2,1-2H3,(H,21,25)