N-[2-[4-(5-fluoranylpyrimidin-2-yl)piperazin-1-yl]ethyl]-2H-1,4-benzoxazin-3-amine

Systemtic Name: N-[2-[4-(5-fluoranylpyrimidin-2-yl)piperazin-1-yl]ethyl]-2H-1,4-benzoxazin-3-amine Openeye Name: N-[2-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]ethyl]-2H-1,4-benzoxazin-3-amine CAS Name: N-[2-[4-(5-fluoro-2-pyrimidinyl)-1-piperazinyl]ethyl]-2H-1,4-benzoxazin-3-amine IUPAC Name: N-[2-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]ethyl]-2H-1,4-benzoxazin-3-amine Traditional Name: 2H-1,4-benzoxazin-3-yl-[2-[4-(5-fluoropyrimidin-2-yl)piperazino]ethyl]amine Formula: C18H21FN6O MolecularWeight: 356.397343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC2=NC3=CC=CC=C3OC2)C4=NC=C(C=N4)F

Isomeric SMILES

C1CN(CCN1CCNC2=NC3=CC=CC=C3OC2)C4=NC=C(C=N4)F

InChI

InChI=1S/C18H21FN6O/c19-14-11-21-18(22-12-14)25-9-7-24(8-10-25)6-5-20-17-13-26-16-4-2-1-3-15(16)23-17/h1-4,11-12H,5-10,13H2,(H,20,23)