4-methoxy-3-nitro-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]benzenesulfonamide

Systemtic Name: 4-methoxy-3-nitro-N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]benzenesulfonamide Openeye Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-4-methoxy-3-nitro-benzenesulfonamide CAS Name: 4-methoxy-3-nitro-N-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]benzenesulfonamide IUPAC Name: N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-4-methoxy-3-nitro-benzenesulfonamide Formula: C24H22N4O5S MolecularWeight: 478.52028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O5S/c1-33-23-13-12-21(14-22(23)28(29)30)34(31,32)25-15-20-17-27(16-18-8-4-2-5-9-18)26-24(20)19-10-6-3-7-11-19/h2-14,17,25H,15-16H2,1H3