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

Systemtic Name: 5-methyl-1-(3-methylsulfanylphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-methyl-1-(3-methylsulfanylphenyl)triazole-4-carboxamide CAS Name: 5-methyl-1-[3-(methylthio)phenyl]-4-triazolecarboxamide IUPAC Name: 5-methyl-1-(3-methylsulfanylphenyl)triazole-4-carboxamide Traditional Name: 5-methyl-1-[3-(methylthio)phenyl]triazole-4-carboxamide Formula: C11H12N4OS MolecularWeight: 248.30418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC(=CC=C2)SC)C(=O)N

Isomeric SMILES

CC1=C(N=NN1C2=CC(=CC=C2)SC)C(=O)N

InChI

InChI=1S/C11H12N4OS/c1-7-10(11(12)16)13-14-15(7)8-4-3-5-9(6-8)17-2/h3-6H,1-2H3,(H2,12,16)