2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfonylphenyl)ethanamide Openeye Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfonylphenyl)acetamide CAS Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(2-methylsulfonylphenyl)acetamide IUPAC Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfonylphenyl)acetamide Traditional Name: N-(2-mesylphenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)NC3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)NC3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C18H18N4O3S2/c1-13-20-21-18(22(13)14-8-4-3-5-9-14)26-12-17(23)19-15-10-6-7-11-16(15)27(2,24)25/h3-11H,12H2,1-2H3,(H,19,23)