4-[[5-azanyl-6-[ethyl(phenyl)amino]pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[[5-azanyl-6-[ethyl(phenyl)amino]pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[5-amino-6-(N-ethylanilino)-4-pyrimidinyl]amino]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]amino]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Formula: C22H28N6O2S MolecularWeight: 440.56172

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)N(CC)C3=CC=CC=C3)N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)N(CC)C3=CC=CC=C3)N

InChI

InChI=1S/C22H28N6O2S/c1-4-27(5-2)31(29,30)19-14-12-17(13-15-19)26-21-20(23)22(25-16-24-21)28(6-3)18-10-8-7-9-11-18/h7-16H,4-6,23H2,1-3H3,(H,24,25,26)