N-cyclopentyl-N-[3-[[6-(2-phenylmethoxyphenyl)pyrimidin-4-yl]amino]phenyl]methanesulfonamide

Systemtic Name: N-cyclopentyl-N-[3-[[6-(2-phenylmethoxyphenyl)pyrimidin-4-yl]amino]phenyl]methanesulfonamide Openeye Name: N-[3-[[6-(2-benzyloxyphenyl)pyrimidin-4-yl]amino]phenyl]-N-cyclopentyl-methanesulfonamide CAS Name: N-cyclopentyl-N-[3-[[6-(2-phenylmethoxyphenyl)-4-pyrimidinyl]amino]phenyl]methanesulfonamide IUPAC Name: N-cyclopentyl-N-[3-[[6-(2-phenylmethoxyphenyl)pyrimidin-4-yl]amino]phenyl]methanesulfonamide Traditional Name: N-[3-[[6-(2-benzoxyphenyl)pyrimidin-4-yl]amino]phenyl]-N-cyclopentyl-methanesulfonamide Formula: C29H30N4O3S MolecularWeight: 514.6385

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1CCCC1)C2=CC=CC(=C2)NC3=NC=NC(=C3)C4=CC=CC=C4OCC5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)N(C1CCCC1)C2=CC=CC(=C2)NC3=NC=NC(=C3)C4=CC=CC=C4OCC5=CC=CC=C5

InChI

InChI=1S/C29H30N4O3S/c1-37(34,35)33(24-13-5-6-14-24)25-15-9-12-23(18-25)32-29-19-27(30-21-31-29)26-16-7-8-17-28(26)36-20-22-10-3-2-4-11-22/h2-4,7-12,15-19,21,24H,5-6,13-14,20H2,1H3,(H,30,31,32)