N,N-diethyl-4-[[7-(4-fluorophenyl)pteridin-4-yl]amino]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[[7-(4-fluorophenyl)pteridin-4-yl]amino]benzenesulfonamide Openeye Name: N,N-diethyl-4-[[7-(4-fluorophenyl)pteridin-4-yl]amino]benzenesulfonamide CAS Name: N,N-diethyl-4-[[7-(4-fluorophenyl)-4-pteridinyl]amino]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[[7-(4-fluorophenyl)pteridin-4-yl]amino]benzenesulfonamide Traditional Name: N,N-diethyl-4-[[7-(4-fluorophenyl)pteridin-4-yl]amino]benzenesulfonamide Formula: C22H21FN6O2S MolecularWeight: 452.504543

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC3=NC(=CN=C32)C4=CC=C(C=C4)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC3=NC(=CN=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN6O2S/c1-3-29(4-2)32(30,31)18-11-9-17(10-12-18)27-21-20-22(26-14-25-21)28-19(13-24-20)15-5-7-16(23)8-6-15/h5-14H,3-4H2,1-2H3,(H,25,26,27,28)