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

Systemtic Name: N-tert-butyl-N-[3-[[6-(2-phenylmethoxyphenyl)pyrimidin-4-yl]amino]phenyl]methanesulfonamide Openeye Name: N-[3-[[6-(2-benzyloxyphenyl)pyrimidin-4-yl]amino]phenyl]-N-tert-butyl-methanesulfonamide CAS Name: N-tert-butyl-N-[3-[[6-(2-phenylmethoxyphenyl)-4-pyrimidinyl]amino]phenyl]methanesulfonamide IUPAC Name: N-tert-butyl-N-[3-[[6-(2-phenylmethoxyphenyl)pyrimidin-4-yl]amino]phenyl]methanesulfonamide Traditional Name: N-[3-[[6-(2-benzoxyphenyl)pyrimidin-4-yl]amino]phenyl]-N-tert-butyl-methanesulfonamide Formula: C28H30N4O3S MolecularWeight: 502.6278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C1=CC=CC(=C1)NC2=NC=NC(=C2)C3=CC=CC=C3OCC4=CC=CC=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)N(C1=CC=CC(=C1)NC2=NC=NC(=C2)C3=CC=CC=C3OCC4=CC=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C28H30N4O3S/c1-28(2,3)32(36(4,33)34)23-14-10-13-22(17-23)31-27-18-25(29-20-30-27)24-15-8-9-16-26(24)35-19-21-11-6-5-7-12-21/h5-18,20H,19H2,1-4H3,(H,29,30,31)