N-[3-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]ethanesulfonamide

Systemtic Name: N-[3-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]ethanesulfonamide Openeye Name: N-[3-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]ethanesulfonamide CAS Name: N-[3-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]ethanesulfonamide IUPAC Name: N-[3-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]ethanesulfonamide Traditional Name: N-[3-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]ethanesulfonamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC=CC(=C1)C2=CC3=C(N2)N=CN=C3NC(C)C4=CC=CC=C4

Isomeric SMILES

CCS(=O)(=O)NC1=CC=CC(=C1)C2=CC3=C(N2)N=CN=C3NC(C)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2S/c1-3-30(28,29)27-18-11-7-10-17(12-18)20-13-19-21(23-14-24-22(19)26-20)25-15(2)16-8-5-4-6-9-16/h4-15,27H,3H2,1-2H3,(H2,23,24,25,26)