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

Systemtic Name: N-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]-4-phenyl-benzenesulfonamide Openeye Name: N-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]-4-phenyl-benzenesulfonamide CAS Name: N-[4-[[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]amino]phenyl]-4-phenylbenzenesulfonamide IUPAC Name: N-[4-[(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)amino]phenyl]-4-phenylbenzenesulfonamide Traditional Name: N-[4-[(4-methyl-6-pyrrolidino-pyrimidin-2-yl)amino]phenyl]-4-phenyl-benzenesulfonamide Formula: C27H27N5O2S MolecularWeight: 485.60058

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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)N5CCCC5

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4)N5CCCC5

InChI

InChI=1S/C27H27N5O2S/c1-20-19-26(32-17-5-6-18-32)30-27(28-20)29-23-11-13-24(14-12-23)31-35(33,34)25-15-9-22(10-16-25)21-7-3-2-4-8-21/h2-4,7-16,19,31H,5-6,17-18H2,1H3,(H,28,29,30)