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

Systemtic Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfonylphenyl)ethanamide Openeye Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfonylphenyl)acetamide CAS Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-N-(2-methylsulfonylphenyl)acetamide IUPAC Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylsulfonylphenyl)acetamide Traditional Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-N-(2-mesylphenyl)acetamide Formula: C14H16N4O3S2 MolecularWeight: 352.43184

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1NC(=O)CSC2=NNC(=N2)C3CC3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1NC(=O)CSC2=NNC(=N2)C3CC3

InChI

InChI=1S/C14H16N4O3S2/c1-23(20,21)11-5-3-2-4-10(11)15-12(19)8-22-14-16-13(17-18-14)9-6-7-9/h2-5,9H,6-8H2,1H3,(H,15,19)(H,16,17,18)