5-bromanyl-1-[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonyl-2H-indazol-3-one

Systemtic Name: 5-bromanyl-1-[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonyl-2H-indazol-3-one Openeye Name: 5-bromo-1-(3-indolin-1-ylsulfonylbenzoyl)-2H-indazol-3-one CAS Name: 5-bromo-1-[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-oxomethyl]-2H-indazol-3-one IUPAC Name: 5-bromo-1-[3-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]-2H-indazol-3-one Traditional Name: 5-bromo-1-(3-indolin-1-ylsulfonylbenzoyl)indazolin-3-one Formula: C22H16BrN3O4S MolecularWeight: 498.34914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)N4C5=C(C=C(C=C5)Br)C(=O)N4

Isomeric SMILES

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)N4C5=C(C=C(C=C5)Br)C(=O)N4

InChI

InChI=1S/C22H16BrN3O4S/c23-16-8-9-20-18(13-16)21(27)24-26(20)22(28)15-5-3-6-17(12-15)31(29,30)25-11-10-14-4-1-2-7-19(14)25/h1-9,12-13H,10-11H2,(H,24,27)