4-(3,5-dimethylphenoxy)-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-5-amine

Systemtic Name: 4-(3,5-dimethylphenoxy)-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-5-amine Openeye Name: 4-(3,5-dimethylphenoxy)-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-5-amine CAS Name: 4-(3,5-dimethylphenoxy)-6-[4-(4-fluorophenyl)-1-piperazinyl]-5-pyrimidinamine IUPAC Name: 4-(3,5-dimethylphenoxy)-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-5-amine Traditional Name: [4-(3,5-dimethylphenoxy)-6-[4-(4-fluorophenyl)piperazino]pyrimidin-5-yl]amine Formula: C22H24FN5O MolecularWeight: 393.457263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)N3CCN(CC3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)N3CCN(CC3)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C22H24FN5O/c1-15-11-16(2)13-19(12-15)29-22-20(24)21(25-14-26-22)28-9-7-27(8-10-28)18-5-3-17(23)4-6-18/h3-6,11-14H,7-10,24H2,1-2H3