N3-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]benzene-1,3-disulfonamide

Systemtic Name: N3-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]benzene-1,3-disulfonamide Openeye Name: N3-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]benzene-1,3-disulfonamide CAS Name: N3-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]benzene-1,3-disulfonamide Traditional Name: N'-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]benzene-1,3-disulfonamide Formula: C23H22N4O4S2 MolecularWeight: 482.57518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)CNS(=O)(=O)C4=CC=CC(=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)CNS(=O)(=O)C4=CC=CC(=C4)S(=O)(=O)N

InChI

InChI=1S/C23H22N4O4S2/c24-32(28,29)21-12-7-13-22(14-21)33(30,31)25-15-20-17-27(16-18-8-3-1-4-9-18)26-23(20)19-10-5-2-6-11-19/h1-14,17,25H,15-16H2,(H2,24,28,29)