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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-[(2-methylphenyl)methyl]ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-(o-tolylmethyl)acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-methyl-N-[(2-methylphenyl)methyl]acetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-[(2-methylphenyl)methyl]acetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-methyl-N-(2-methylbenzyl)acetamide Formula: C13H17N5OS MolecularWeight: 291.37198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C)C(=O)CSC2=NNC(=N2)N

Isomeric SMILES

CC1=CC=CC=C1CN(C)C(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C13H17N5OS/c1-9-5-3-4-6-10(9)7-18(2)11(19)8-20-13-15-12(14)16-17-13/h3-6H,7-8H2,1-2H3,(H3,14,15,16,17)