N-(3-chlorophenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(3-chlorophenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(3-chlorophenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-(3-chlorophenyl)-4-(2-methyl-6-phenoxy-4-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-(3-chlorophenyl)-4-(2-methyl-6-phenoxypyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(3-chlorophenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide Formula: C22H22ClN5O2 MolecularWeight: 423.89538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)OC2=CC=CC=C2)N3CCN(CC3)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=NC(=CC(=N1)OC2=CC=CC=C2)N3CCN(CC3)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H22ClN5O2/c1-16-24-20(15-21(25-16)30-19-8-3-2-4-9-19)27-10-12-28(13-11-27)22(29)26-18-7-5-6-17(23)14-18/h2-9,14-15H,10-13H2,1H3,(H,26,29)