2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethanoylphenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethanoylphenyl)ethanamide Openeye Name: N-(2-acetylphenyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2-acetylphenyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-acetylphenyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-acetylphenyl)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)CSC2=NN=C(N2N)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)CSC2=NN=C(N2N)C(C)(C)C

InChI

InChI=1S/C16H21N5O2S/c1-10(22)11-7-5-6-8-12(11)18-13(23)9-24-15-20-19-14(21(15)17)16(2,3)4/h5-8H,9,17H2,1-4H3,(H,18,23)