1-[3-[[6-(3-ethoxyphenyl)pyrimidin-4-yl]amino]phenyl]-N,N-dimethyl-methanesulfonamide

Systemtic Name: 1-[3-[[6-(3-ethoxyphenyl)pyrimidin-4-yl]amino]phenyl]-N,N-dimethyl-methanesulfonamide Openeye Name: 1-[3-[[6-(3-ethoxyphenyl)pyrimidin-4-yl]amino]phenyl]-N,N-dimethyl-methanesulfonamide CAS Name: 1-[3-[[6-(3-ethoxyphenyl)-4-pyrimidinyl]amino]phenyl]-N,N-dimethylmethanesulfonamide IUPAC Name: 1-[3-[[6-(3-ethoxyphenyl)pyrimidin-4-yl]amino]phenyl]-N,N-dimethylmethanesulfonamide Traditional Name: N,N-dimethyl-1-[3-[(6-m-phenetylpyrimidin-4-yl)amino]phenyl]methanesulfonamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=CC(=NC=N2)NC3=CC=CC(=C3)CS(=O)(=O)N(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=CC(=NC=N2)NC3=CC=CC(=C3)CS(=O)(=O)N(C)C

InChI

InChI=1S/C21H24N4O3S/c1-4-28-19-10-6-8-17(12-19)20-13-21(23-15-22-20)24-18-9-5-7-16(11-18)14-29(26,27)25(2)3/h5-13,15H,4,14H2,1-3H3,(H,22,23,24)