4-[5-(4-ethylsulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]aniline

Systemtic Name: 4-[5-(4-ethylsulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]aniline Openeye Name: 4-[5-(4-ethylsulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]aniline CAS Name: 4-[5-(4-ethylsulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]aniline IUPAC Name: 4-[5-(4-ethylsulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]aniline Traditional Name: [4-[5-(4-esylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]phenyl]amine Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)C2=CN=C3C(=C2)C(=CN3)C4=CC=C(C=C4)N

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)C2=CN=C3C(=C2)C(=CN3)C4=CC=C(C=C4)N

InChI

InChI=1S/C21H19N3O2S/c1-2-27(25,26)18-9-5-14(6-10-18)16-11-19-20(13-24-21(19)23-12-16)15-3-7-17(22)8-4-15/h3-13H,2,22H2,1H3,(H,23,24)