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

Systemtic Name: N-(4-chlorophenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(4-chlorophenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-(4-chlorophenyl)-4-(2-methyl-6-phenoxy-4-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-(4-chlorophenyl)-4-(2-methyl-6-phenoxypyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(4-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=C(C=C4)Cl

Isomeric SMILES

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

InChI

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