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

Systemtic Name: 2-[[4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfonylphenyl)ethanamide Openeye Name: 2-[[4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfonylphenyl)acetamide CAS Name: 2-[[4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]-N-(3-methylsulfonylphenyl)acetamide IUPAC Name: 2-[[4-methyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfonylphenyl)acetamide Traditional Name: N-(3-mesylphenyl)-2-[[4-methyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H18N4O4S2 MolecularWeight: 406.47922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C17H18N4O4S2/c1-11-14(7-8-25-11)16-19-20-17(21(16)2)26-10-15(22)18-12-5-4-6-13(9-12)27(3,23)24/h4-9H,10H2,1-3H3,(H,18,22)