N,N-diethyl-4-[4-(oxolan-2-ylmethylamino)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[4-(oxolan-2-ylmethylamino)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[5-phenyl-4-(tetrahydrofuran-2-ylmethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]benzenesulfonamide CAS Name: N,N-diethyl-4-[4-(2-oxolanylmethylamino)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[4-(oxolan-2-ylmethylamino)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[5-phenyl-4-(tetrahydrofurfurylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]benzenesulfonamide Formula: C27H31N5O3S MolecularWeight: 505.63174

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=C(C3=C(N2)N=CN=C3NCC4CCCO4)C5=CC=CC=C5

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=C(C3=C(N2)N=CN=C3NCC4CCCO4)C5=CC=CC=C5

InChI

InChI=1S/C27H31N5O3S/c1-3-32(4-2)36(33,34)22-14-12-20(13-15-22)25-23(19-9-6-5-7-10-19)24-26(29-18-30-27(24)31-25)28-17-21-11-8-16-35-21/h5-7,9-10,12-15,18,21H,3-4,8,11,16-17H2,1-2H3,(H2,28,29,30,31)