5-methoxy-1-[1-phenyl-2-(phenylsulfonyl)ethyl]-2H-indazol-3-one

Systemtic Name: 5-methoxy-1-[1-phenyl-2-(phenylsulfonyl)ethyl]-2H-indazol-3-one Openeye Name: 1-[2-(benzenesulfonyl)-1-phenyl-ethyl]-5-methoxy-2H-indazol-3-one CAS Name: 1-[2-(benzenesulfonyl)-1-phenylethyl]-5-methoxy-2H-indazol-3-one IUPAC Name: 1-[2-(benzenesulfonyl)-1-phenylethyl]-5-methoxy-2H-indazol-3-one Traditional Name: 1-(2-besyl-1-phenyl-ethyl)-5-methoxy-indazolin-3-one Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(NC2=O)C(CS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N(NC2=O)C(CS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O4S/c1-28-17-12-13-20-19(14-17)22(25)23-24(20)21(16-8-4-2-5-9-16)15-29(26,27)18-10-6-3-7-11-18/h2-14,21H,15H2,1H3,(H,23,25)