N-(5-phenethylsulfonyl-1H-1,2,4-triazol-3-yl)ethanamide

Systemtic Name: N-(5-phenethylsulfonyl-1H-1,2,4-triazol-3-yl)ethanamide Openeye Name: N-(5-phenethylsulfonyl-1H-1,2,4-triazol-3-yl)acetamide CAS Name: N-(5-phenethylsulfonyl-1H-1,2,4-triazol-3-yl)acetamide IUPAC Name: N-(5-phenethylsulfonyl-1H-1,2,4-triazol-3-yl)acetamide Traditional Name: N-(5-phenethylsulfonyl-1H-1,2,4-triazol-3-yl)acetamide Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NNC(=N1)S(=O)(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=NNC(=N1)S(=O)(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C12H14N4O3S/c1-9(17)13-11-14-12(16-15-11)20(18,19)8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H2,13,14,15,16,17)