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

Systemtic Name: 5-azanyl-N-(4-bromophenyl)-1-[(4-ethylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-(4-bromophenyl)-1-[(4-ethylphenyl)methyl]triazole-4-carboxamide CAS Name: 5-amino-N-(4-bromophenyl)-1-[(4-ethylphenyl)methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-(4-bromophenyl)-1-[(4-ethylphenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-N-(4-bromophenyl)-1-(4-ethylbenzyl)triazole-4-carboxamide Formula: C18H18BrN5O MolecularWeight: 400.27242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)NC3=CC=C(C=C3)Br)N

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)NC3=CC=C(C=C3)Br)N

InChI

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