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

Systemtic Name: 2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylsulfonylphenyl)ethanamide Openeye Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylsulfonylphenyl)acetamide CAS Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(3-methylsulfonylphenyl)acetamide IUPAC Name: 2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylsulfonylphenyl)acetamide Traditional Name: 2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(3-mesylphenyl)acetamide Formula: C15H20N4O4S2 MolecularWeight: 384.4737

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C15H20N4O4S2/c1-3-4-8-19-14(21)17-18-15(19)24-10-13(20)16-11-6-5-7-12(9-11)25(2,22)23/h5-7,9H,3-4,8,10H2,1-2H3,(H,16,20)(H,17,21)