N-[4-[(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)amino]phenyl]-4-phenyl-benzenesulfonamide

Systemtic Name: N-[4-[(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)amino]phenyl]-4-phenyl-benzenesulfonamide Openeye Name: N-[4-[[4-methyl-6-(1-piperidyl)pyrimidin-2-yl]amino]phenyl]-4-phenyl-benzenesulfonamide CAS Name: N-[4-[[4-methyl-6-(1-piperidinyl)-2-pyrimidinyl]amino]phenyl]-4-phenylbenzenesulfonamide IUPAC Name: N-[4-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)amino]phenyl]-4-phenylbenzenesulfonamide Traditional Name: N-[4-[(4-methyl-6-piperidino-pyrimidin-2-yl)amino]phenyl]-4-phenyl-benzenesulfonamide Formula: C28H29N5O2S MolecularWeight: 499.62716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4)N5CCCCC5

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4)N5CCCCC5

InChI

InChI=1S/C28H29N5O2S/c1-21-20-27(33-18-6-3-7-19-33)31-28(29-21)30-24-12-14-25(15-13-24)32-36(34,35)26-16-10-23(11-17-26)22-8-4-2-5-9-22/h2,4-5,8-17,20,32H,3,6-7,18-19H2,1H3,(H,29,30,31)