N,N-dibutyl-1-methyl-3-phenyl-pyrazole-4-sulfonamide

Systemtic Name: N,N-dibutyl-1-methyl-3-phenyl-pyrazole-4-sulfonamide Openeye Name: N,N-dibutyl-1-methyl-3-phenyl-pyrazole-4-sulfonamide CAS Name: N,N-dibutyl-1-methyl-3-phenyl-4-pyrazolesulfonamide IUPAC Name: N,N-dibutyl-1-methyl-3-phenylpyrazole-4-sulfonamide Traditional Name: N,N-dibutyl-1-methyl-3-phenyl-pyrazole-4-sulfonamide Formula: C18H27N3O2S MolecularWeight: 349.49088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)S(=O)(=O)C1=CN(N=C1C2=CC=CC=C2)C

Isomeric SMILES

CCCCN(CCCC)S(=O)(=O)C1=CN(N=C1C2=CC=CC=C2)C

InChI

InChI=1S/C18H27N3O2S/c1-4-6-13-21(14-7-5-2)24(22,23)17-15-20(3)19-18(17)16-11-9-8-10-12-16/h8-12,15H,4-7,13-14H2,1-3H3