N-[3-[4-[(2,4-dimethoxyphenyl)methylamino]pyrimidin-2-yl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[4-[(2,4-dimethoxyphenyl)methylamino]pyrimidin-2-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[4-[(2,4-dimethoxyphenyl)methylamino]pyrimidin-2-yl]phenyl]methanesulfonamide CAS Name: N-[3-[4-[(2,4-dimethoxyphenyl)methylamino]-2-pyrimidinyl]phenyl]methanesulfonamide IUPAC Name: N-[3-[4-[(2,4-dimethoxyphenyl)methylamino]pyrimidin-2-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[4-[(2,4-dimethoxybenzyl)amino]pyrimidin-2-yl]phenyl]methanesulfonamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=NC(=NC=C2)C3=CC(=CC=C3)NS(=O)(=O)C)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=NC(=NC=C2)C3=CC(=CC=C3)NS(=O)(=O)C)OC

InChI

InChI=1S/C20H22N4O4S/c1-27-17-8-7-15(18(12-17)28-2)13-22-19-9-10-21-20(23-19)14-5-4-6-16(11-14)24-29(3,25)26/h4-12,24H,13H2,1-3H3,(H,21,22,23)