N-(4-butyl-2-methyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methanesulfonamide

Systemtic Name: N-(4-butyl-2-methyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methanesulfonamide Openeye Name: N-(4-butyl-2-methyl-5-oxo-1-phenyl-pyrazol-3-yl)methanesulfonamide CAS Name: N-(4-butyl-2-methyl-5-oxo-1-phenyl-3-pyrazolyl)methanesulfonamide IUPAC Name: N-(4-butyl-2-methyl-5-oxo-1-phenylpyrazol-3-yl)methanesulfonamide Traditional Name: N-(4-butyl-5-keto-2-methyl-1-phenyl-3-pyrazolin-3-yl)methanesulfonamide Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(N(C1=O)C2=CC=CC=C2)C)NS(=O)(=O)C

Isomeric SMILES

CCCCC1=C(N(N(C1=O)C2=CC=CC=C2)C)NS(=O)(=O)C

InChI

InChI=1S/C15H21N3O3S/c1-4-5-11-13-14(16-22(3,20)21)17(2)18(15(13)19)12-9-7-6-8-10-12/h6-10,16H,4-5,11H2,1-3H3