N-[2-(5-azanylpyrrolo[3,2-b]pyridin-1-yl)-5-chloranyl-pyridin-3-yl]-4-tert-butyl-benzenesulfonamide

Systemtic Name: N-[2-(5-azanylpyrrolo[3,2-b]pyridin-1-yl)-5-chloranyl-pyridin-3-yl]-4-tert-butyl-benzenesulfonamide Openeye Name: N-[2-(5-aminopyrrolo[3,2-b]pyridin-1-yl)-5-chloro-3-pyridyl]-4-tert-butyl-benzenesulfonamide CAS Name: N-[2-(5-amino-1-pyrrolo[3,2-b]pyridinyl)-5-chloro-3-pyridinyl]-4-tert-butylbenzenesulfonamide IUPAC Name: N-[2-(5-aminopyrrolo[3,2-b]pyridin-1-yl)-5-chloropyridin-3-yl]-4-tert-butylbenzenesulfonamide Traditional Name: N-[2-(5-aminopyrrolo[3,2-b]pyridin-1-yl)-5-chloro-3-pyridyl]-4-tert-butyl-benzenesulfonamide Formula: C22H22ClN5O2S MolecularWeight: 455.96038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CN=C2N3C=CC4=C3C=CC(=N4)N)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CN=C2N3C=CC4=C3C=CC(=N4)N)Cl

InChI

InChI=1S/C22H22ClN5O2S/c1-22(2,3)14-4-6-16(7-5-14)31(29,30)27-18-12-15(23)13-25-21(18)28-11-10-17-19(28)8-9-20(24)26-17/h4-13,27H,1-3H3,(H2,24,26)