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

Systemtic Name: 5-azanyl-1-[(4-bromophenyl)methyl]-N-(2-methoxy-5-methyl-phenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[(4-bromophenyl)methyl]-N-(2-methoxy-5-methyl-phenyl)triazole-4-carboxamide CAS Name: 5-amino-1-[(4-bromophenyl)methyl]-N-(2-methoxy-5-methylphenyl)-4-triazolecarboxamide IUPAC Name: 5-amino-1-[(4-bromophenyl)methyl]-N-(2-methoxy-5-methylphenyl)triazole-4-carboxamide Traditional Name: 5-amino-1-(4-bromobenzyl)-N-(2-methoxy-5-methyl-phenyl)triazole-4-carboxamide Formula: C18H18BrN5O2 MolecularWeight: 416.27182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrN5O2/c1-11-3-8-15(26-2)14(9-11)21-18(25)16-17(20)24(23-22-16)10-12-4-6-13(19)7-5-12/h3-9H,10,20H2,1-2H3,(H,21,25)