4-[2-[(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[(5,7-diphenyl-4-pyrrolo[2,3-d]pyrimidinyl)amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Formula: C26H23N5O2S MolecularWeight: 469.55812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)NCCC4=CC=C(C=C4)S(=O)(=O)N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C3=C2C(=NC=N3)NCCC4=CC=C(C=C4)S(=O)(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C26H23N5O2S/c27-34(32,33)22-13-11-19(12-14-22)15-16-28-25-24-23(20-7-3-1-4-8-20)17-31(26(24)30-18-29-25)21-9-5-2-6-10-21/h1-14,17-18H,15-16H2,(H2,27,32,33)(H,28,29,30)