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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=NNC(=N2)N

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C13H17N5OS/c1-3-18(10-6-4-5-9(2)7-10)11(19)8-20-13-15-12(14)16-17-13/h4-7H,3,8H2,1-2H3,(H3,14,15,16,17)