N-(4-bromophenyl)-5-methyl-1-(3-methylsulfanylphenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(4-bromophenyl)-5-methyl-1-(3-methylsulfanylphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(4-bromophenyl)-5-methyl-1-(3-methylsulfanylphenyl)triazole-4-carboxamide CAS Name: N-(4-bromophenyl)-5-methyl-1-[3-(methylthio)phenyl]-4-triazolecarboxamide IUPAC Name: N-(4-bromophenyl)-5-methyl-1-(3-methylsulfanylphenyl)triazole-4-carboxamide Traditional Name: N-(4-bromophenyl)-5-methyl-1-[3-(methylthio)phenyl]triazole-4-carboxamide Formula: C17H15BrN4OS MolecularWeight: 403.2962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC(=CC=C2)SC)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(N=NN1C2=CC(=CC=C2)SC)C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN4OS/c1-11-16(17(23)19-13-8-6-12(18)7-9-13)20-21-22(11)14-4-3-5-15(10-14)24-2/h3-10H,1-2H3,(H,19,23)