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

Systemtic Name: N-cyclopentyl-N-[4-[[6-(2-phenylmethoxyphenyl)pyrimidin-4-yl]amino]phenyl]methanesulfonamide Openeye Name: N-[4-[[6-(2-benzyloxyphenyl)pyrimidin-4-yl]amino]phenyl]-N-cyclopentyl-methanesulfonamide CAS Name: N-cyclopentyl-N-[4-[[6-(2-phenylmethoxyphenyl)-4-pyrimidinyl]amino]phenyl]methanesulfonamide IUPAC Name: N-cyclopentyl-N-[4-[[6-(2-phenylmethoxyphenyl)pyrimidin-4-yl]amino]phenyl]methanesulfonamide Traditional Name: N-[4-[[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=C(C=C2)NC3=NC=NC(=C3)C4=CC=CC=C4OCC5=CC=CC=C5

Isomeric SMILES

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

InChI

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