2-(4-chloranylphenoxy)-1-[4-(6-imidazol-1-yl-2-methyl-pyrimidin-4-yl)piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 2-(4-chloranylphenoxy)-1-[4-(6-imidazol-1-yl-2-methyl-pyrimidin-4-yl)piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 2-(4-chlorophenoxy)-1-[4-(6-imidazol-1-yl-2-methyl-pyrimidin-4-yl)piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 2-(4-chlorophenoxy)-1-[4-[6-(1-imidazolyl)-2-methyl-4-pyrimidinyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 2-(4-chlorophenoxy)-1-[4-(6-imidazol-1-yl-2-methylpyrimidin-4-yl)piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 2-(4-chlorophenoxy)-1-[4-(6-imidazol-1-yl-2-methyl-pyrimidin-4-yl)piperazino]-2-methyl-propan-1-one Formula: C22H25ClN6O2 MolecularWeight: 440.9259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)C(C)(C)OC3=CC=C(C=C3)Cl)N4C=CN=C4

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)C(C)(C)OC3=CC=C(C=C3)Cl)N4C=CN=C4

InChI

InChI=1S/C22H25ClN6O2/c1-16-25-19(14-20(26-16)29-9-8-24-15-29)27-10-12-28(13-11-27)21(30)22(2,3)31-18-6-4-17(23)5-7-18/h4-9,14-15H,10-13H2,1-3H3