4-[bis(fluoranyl)methyl]-6-(3,4-dimethoxyphenyl)-2-piperazin-1-yl-pyrimidine

Systemtic Name: 4-[bis(fluoranyl)methyl]-6-(3,4-dimethoxyphenyl)-2-piperazin-1-yl-pyrimidine Openeye Name: 4-(difluoromethyl)-6-(3,4-dimethoxyphenyl)-2-piperazin-1-yl-pyrimidine CAS Name: 4-(difluoromethyl)-6-(3,4-dimethoxyphenyl)-2-(1-piperazinyl)pyrimidine IUPAC Name: 4-(difluoromethyl)-6-(3,4-dimethoxyphenyl)-2-piperazin-1-ylpyrimidine Traditional Name: 4-(difluoromethyl)-6-(3,4-dimethoxyphenyl)-2-piperazino-pyrimidine Formula: C17H20F2N4O2 MolecularWeight: 350.363106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NC(=N2)N3CCNCC3)C(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NC(=N2)N3CCNCC3)C(F)F)OC

InChI

InChI=1S/C17H20F2N4O2/c1-24-14-4-3-11(9-15(14)25-2)12-10-13(16(18)19)22-17(21-12)23-7-5-20-6-8-23/h3-4,9-10,16,20H,5-8H2,1-2H3