N-[4-[4-[(3-chlorophenyl)amino]-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]benzenesulfonamide

Systemtic Name: N-[4-[4-[(3-chlorophenyl)amino]-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]benzenesulfonamide Openeye Name: N-[4-[4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]benzenesulfonamide CAS Name: N-[4-[4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]benzenesulfonamide IUPAC Name: N-[4-[4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]benzenesulfonamide Traditional Name: N-[4-[4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]benzenesulfonamide Formula: C24H18ClN5O2S MolecularWeight: 475.95002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=CC4=C(N3)N=CN=C4NC5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=CC4=C(N3)N=CN=C4NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C24H18ClN5O2S/c25-17-5-4-6-19(13-17)28-23-21-14-22(29-24(21)27-15-26-23)16-9-11-18(12-10-16)30-33(31,32)20-7-2-1-3-8-20/h1-15,30H,(H2,26,27,28,29)