N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-3-(2-pyrimidylamino)benzamide Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=CC=C1)NC2=NC=CC=N2)C3=CC=CC=C3Cl

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=CC=C1)NC2=NC=CC=N2)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H22ClN5O/c1-27(2)19(17-9-3-4-10-18(17)22)14-25-20(28)15-7-5-8-16(13-15)26-21-23-11-6-12-24-21/h3-13,19H,14H2,1-2H3,(H,25,28)(H,23,24,26)