4-butyl-N-[3-(3-methylpyrazol-1-yl)propyl]benzenesulfonamide

Systemtic Name: 4-butyl-N-[3-(3-methylpyrazol-1-yl)propyl]benzenesulfonamide Openeye Name: 4-butyl-N-[3-(3-methylpyrazol-1-yl)propyl]benzenesulfonamide CAS Name: 4-butyl-N-[3-(3-methyl-1-pyrazolyl)propyl]benzenesulfonamide IUPAC Name: 4-butyl-N-[3-(3-methylpyrazol-1-yl)propyl]benzenesulfonamide Traditional Name: 4-butyl-N-[3-(3-methylpyrazol-1-yl)propyl]benzenesulfonamide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NCCCN2C=CC(=N2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NCCCN2C=CC(=N2)C

InChI

InChI=1S/C17H25N3O2S/c1-3-4-6-16-7-9-17(10-8-16)23(21,22)18-12-5-13-20-14-11-15(2)19-20/h7-11,14,18H,3-6,12-13H2,1-2H3