2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethanoylphenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethanoylphenyl)ethanamide Openeye Name: N-(3-acetylphenyl)-2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(3-acetylphenyl)-2-[(4-amino-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-acetylphenyl)-2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-acetylphenyl)-2-[(4-amino-1,2,4-triazol-3-yl)thio]acetamide Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=CN2N

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=CN2N

InChI

InChI=1S/C12H13N5O2S/c1-8(18)9-3-2-4-10(5-9)15-11(19)6-20-12-16-14-7-17(12)13/h2-5,7H,6,13H2,1H3,(H,15,19)