N-(4-methylsulfonylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-methylsulfonylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-methylsulfonylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-methylsulfonylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-methylsulfonylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-mesylphenyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C17H16N4O3S2 MolecularWeight: 388.46394

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=CN2C3=CC=CC=C3

InChI

InChI=1S/C17H16N4O3S2/c1-26(23,24)15-9-7-13(8-10-15)19-16(22)11-25-17-20-18-12-21(17)14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,19,22)