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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

InChI

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