N-[3-[6-[(2,4-dimethoxyphenyl)methylamino]pyrimidin-4-yl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[6-[(2,4-dimethoxyphenyl)methylamino]pyrimidin-4-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[6-[(2,4-dimethoxyphenyl)methylamino]pyrimidin-4-yl]phenyl]methanesulfonamide CAS Name: N-[3-[6-[(2,4-dimethoxyphenyl)methylamino]-4-pyrimidinyl]phenyl]methanesulfonamide IUPAC Name: N-[3-[6-[(2,4-dimethoxyphenyl)methylamino]pyrimidin-4-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[6-[(2,4-dimethoxybenzyl)amino]pyrimidin-4-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(19(10-17)28-2)12-21-20-11-18(22-13-23-20)14-5-4-6-16(9-14)24-29(3,25)26/h4-11,13,24H,12H2,1-3H3,(H,21,22,23)