4-[[4-(4-oxidanylpiperidin-1-yl)-6-phenyl-pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[4-(4-oxidanylpiperidin-1-yl)-6-phenyl-pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[4-(4-hydroxy-1-piperidyl)-6-phenyl-pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[4-(4-hydroxy-1-piperidinyl)-6-phenyl-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 4-[[4-(4-hydroxypiperidin-1-yl)-6-phenylpyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[4-(4-hydroxypiperidino)-6-phenyl-pyrimidin-2-yl]amino]benzenesulfonamide Formula: C21H23N5O3S MolecularWeight: 425.50402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2=NC(=NC(=C2)C3=CC=CC=C3)NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CN(CCC1O)C2=NC(=NC(=C2)C3=CC=CC=C3)NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C21H23N5O3S/c22-30(28,29)18-8-6-16(7-9-18)23-21-24-19(15-4-2-1-3-5-15)14-20(25-21)26-12-10-17(27)11-13-26/h1-9,14,17,27H,10-13H2,(H2,22,28,29)(H,23,24,25)