2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-ethanoylphenyl)ethanamide

Systemtic Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-ethanoylphenyl)ethanamide Openeye Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-acetylphenyl)acetamide CAS Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(3-acetylphenyl)acetamide IUPAC Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-acetylphenyl)acetamide Traditional Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(3-acetylphenyl)acetamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NNC(=N2)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NNC(=N2)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C20H19N5O3S/c1-12(26)15-4-3-5-17(10-15)22-18(28)11-29-20-23-19(24-25-20)14-6-8-16(9-7-14)21-13(2)27/h3-10H,11H2,1-2H3,(H,21,27)(H,22,28)(H,23,24,25)