4-[4-[2-(4-fluorophenyl)ethyl]-1,4-diazepan-1-yl]-6-methyl-pyrimidin-2-amine

Systemtic Name: 4-[4-[2-(4-fluorophenyl)ethyl]-1,4-diazepan-1-yl]-6-methyl-pyrimidin-2-amine Openeye Name: 4-[4-[2-(4-fluorophenyl)ethyl]-1,4-diazepan-1-yl]-6-methyl-pyrimidin-2-amine CAS Name: 4-[4-[2-(4-fluorophenyl)ethyl]-1,4-diazepan-1-yl]-6-methyl-2-pyrimidinamine IUPAC Name: 4-[4-[2-(4-fluorophenyl)ethyl]-1,4-diazepan-1-yl]-6-methylpyrimidin-2-amine Traditional Name: [4-[4-[2-(4-fluorophenyl)ethyl]-1,4-diazepan-1-yl]-6-methyl-pyrimidin-2-yl]amine Formula: C18H24FN5 MolecularWeight: 329.415063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)N2CCCN(CC2)CCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=NC(=N1)N)N2CCCN(CC2)CCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H24FN5/c1-14-13-17(22-18(20)21-14)24-9-2-8-23(11-12-24)10-7-15-3-5-16(19)6-4-15/h3-6,13H,2,7-12H2,1H3,(H2,20,21,22)