N-[(8-ethyl-6-fluoranyl-3,4-dihydro-2H-chromen-2-yl)methyl]-N'-pyrimidin-2-yl-propane-1,3-diamine

Systemtic Name: N-[(8-ethyl-6-fluoranyl-3,4-dihydro-2H-chromen-2-yl)methyl]-N'-pyrimidin-2-yl-propane-1,3-diamine Openeye Name: N-[(8-ethyl-6-fluoro-chroman-2-yl)methyl]-N'-pyrimidin-2-yl-propane-1,3-diamine CAS Name: N-[(8-ethyl-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl)methyl]-N'-(2-pyrimidinyl)propane-1,3-diamine IUPAC Name: N-[(8-ethyl-6-fluoro-3,4-dihydro-2H-chromen-2-yl)methyl]-N'-pyrimidin-2-ylpropane-1,3-diamine Traditional Name: (8-ethyl-6-fluoro-chroman-2-yl)methyl-[3-(2-pyrimidylamino)propyl]amine Formula: C19H25FN4O MolecularWeight: 344.426403

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1)F)CCC(O2)CNCCCNC3=NC=CC=N3

Isomeric SMILES

CCC1=C2C(=CC(=C1)F)CCC(O2)CNCCCNC3=NC=CC=N3

InChI

InChI=1S/C19H25FN4O/c1-2-14-11-16(20)12-15-5-6-17(25-18(14)15)13-21-7-3-8-22-19-23-9-4-10-24-19/h4,9-12,17,21H,2-3,5-8,13H2,1H3,(H,22,23,24)