4-butyl-N-[(1,3-diphenylpyrazol-4-yl)methyl]benzenesulfonamide

Systemtic Name: 4-butyl-N-[(1,3-diphenylpyrazol-4-yl)methyl]benzenesulfonamide Openeye Name: 4-butyl-N-[(1,3-diphenylpyrazol-4-yl)methyl]benzenesulfonamide CAS Name: 4-butyl-N-[(1,3-diphenyl-4-pyrazolyl)methyl]benzenesulfonamide IUPAC Name: 4-butyl-N-[(1,3-diphenylpyrazol-4-yl)methyl]benzenesulfonamide Traditional Name: 4-butyl-N-[(1,3-diphenylpyrazol-4-yl)methyl]benzenesulfonamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O2S/c1-2-3-10-21-15-17-25(18-16-21)32(30,31)27-19-23-20-29(24-13-8-5-9-14-24)28-26(23)22-11-6-4-7-12-22/h4-9,11-18,20,27H,2-3,10,19H2,1H3