N-[[7-fluoranyl-2-(2-phenylsulfanylethoxy)quinolin-3-yl]methyl]-3-morpholin-4-yl-propan-1-amine

Systemtic Name: N-[[7-fluoranyl-2-(2-phenylsulfanylethoxy)quinolin-3-yl]methyl]-3-morpholin-4-yl-propan-1-amine Openeye Name: N-[[7-fluoro-2-(2-phenylsulfanylethoxy)-3-quinolyl]methyl]-3-morpholino-propan-1-amine CAS Name: N-[[7-fluoro-2-[2-(phenylthio)ethoxy]-3-quinolinyl]methyl]-3-(4-morpholinyl)-1-propanamine IUPAC Name: N-[[7-fluoro-2-(2-phenylsulfanylethoxy)quinolin-3-yl]methyl]-3-morpholin-4-ylpropan-1-amine Traditional Name: [7-fluoro-2-[2-(phenylthio)ethoxy]-3-quinolyl]methyl-(3-morpholinopropyl)amine Formula: C25H30FN3O2S MolecularWeight: 455.588003

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNCC2=C(N=C3C=C(C=CC3=C2)F)OCCSC4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCCNCC2=C(N=C3C=C(C=CC3=C2)F)OCCSC4=CC=CC=C4

InChI

InChI=1S/C25H30FN3O2S/c26-22-8-7-20-17-21(19-27-9-4-10-29-11-13-30-14-12-29)25(28-24(20)18-22)31-15-16-32-23-5-2-1-3-6-23/h1-3,5-8,17-18,27H,4,9-16,19H2