2-[[5-[azanyl-(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-[azanyl-(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-[amino(m-tolyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-[amino-(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-[amino-(3-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[5-[amino(m-tolyl)methyl]-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C12H15N5OS MolecularWeight: 277.3454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=NC(=NN2)SCC(=O)N)N

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=NC(=NN2)SCC(=O)N)N

InChI

InChI=1S/C12H15N5OS/c1-7-3-2-4-8(5-7)10(14)11-15-12(17-16-11)19-6-9(13)18/h2-5,10H,6,14H2,1H3,(H2,13,18)(H,15,16,17)