4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide Openeye Name: 4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide CAS Name: 4-[2-(3-fluorophenyl)-6-methyl-4-pyrimidinyl]-N,N-dimethyl-1-piperazinecarboxamide IUPAC Name: 4-[2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]-N,N-dimethylpiperazine-1-carboxamide Traditional Name: 4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide Formula: C18H22FN5O MolecularWeight: 343.398583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)C(=O)N(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)C(=O)N(C)C

InChI

InChI=1S/C18H22FN5O/c1-13-11-16(21-17(20-13)14-5-4-6-15(19)12-14)23-7-9-24(10-8-23)18(25)22(2)3/h4-6,11-12H,7-10H2,1-3H3