N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-4-butyl-benzenesulfonamide

Systemtic Name: N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-4-butyl-benzenesulfonamide Openeye Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-4-butyl-benzenesulfonamide CAS Name: N-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-4-butylbenzenesulfonamide IUPAC Name: N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-4-butylbenzenesulfonamide Traditional Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-4-butyl-benzenesulfonamide Formula: C18H26BrN3O2S MolecularWeight: 428.38694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26BrN3O2S/c1-4-5-7-16-8-10-17(11-9-16)25(23,24)20-12-6-13-22-15(3)18(19)14(2)21-22/h8-11,20H,4-7,12-13H2,1-3H3