4-[[5-azanyl-6-(2,3-dihydroindol-1-yl)pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[[5-azanyl-6-(2,3-dihydroindol-1-yl)pyrimidin-4-yl]amino]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[(5-amino-6-indolin-1-yl-pyrimidin-4-yl)amino]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[5-amino-6-(2,3-dihydroindol-1-yl)-4-pyrimidinyl]amino]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[[5-amino-6-(2,3-dihydroindol-1-yl)pyrimidin-4-yl]amino]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[(5-amino-6-indolin-1-yl-pyrimidin-4-yl)amino]-N,N-diethyl-benzenesulfonamide Formula: C22H26N6O2S MolecularWeight: 438.54584

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC(=C2N)N3CCC4=CC=CC=C43

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC(=C2N)N3CCC4=CC=CC=C43

InChI

InChI=1S/C22H26N6O2S/c1-3-27(4-2)31(29,30)18-11-9-17(10-12-18)26-21-20(23)22(25-15-24-21)28-14-13-16-7-5-6-8-19(16)28/h5-12,15H,3-4,13-14,23H2,1-2H3,(H,24,25,26)