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

Systemtic Name: 5-azanyl-N-(4-bromanyl-3-methyl-phenyl)-1-[(4-ethylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-(4-bromo-3-methyl-phenyl)-1-[(4-ethylphenyl)methyl]triazole-4-carboxamide CAS Name: 5-amino-N-(4-bromo-3-methylphenyl)-1-[(4-ethylphenyl)methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-(4-bromo-3-methylphenyl)-1-[(4-ethylphenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-N-(4-bromo-3-methyl-phenyl)-1-(4-ethylbenzyl)triazole-4-carboxamide Formula: C19H20BrN5O MolecularWeight: 414.299

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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)C)N

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN5O/c1-3-13-4-6-14(7-5-13)11-25-18(21)17(23-24-25)19(26)22-15-8-9-16(20)12(2)10-15/h4-10H,3,11,21H2,1-2H3,(H,22,26)