N-[[2-(2-chloranylprop-2-enoxy)-7-methylsulfanyl-quinolin-3-yl]methyl]-2-morpholin-4-yl-2-pyridin-3-yl-ethanamine

Systemtic Name: N-[[2-(2-chloranylprop-2-enoxy)-7-methylsulfanyl-quinolin-3-yl]methyl]-2-morpholin-4-yl-2-pyridin-3-yl-ethanamine Openeye Name: N-[[2-(2-chloroallyloxy)-7-methylsulfanyl-3-quinolyl]methyl]-2-morpholino-2-(3-pyridyl)ethanamine CAS Name: N-[[2-(2-chloroprop-2-enoxy)-7-(methylthio)-3-quinolinyl]methyl]-2-(4-morpholinyl)-2-(3-pyridinyl)ethanamine IUPAC Name: N-[[2-(2-chloroprop-2-enoxy)-7-methylsulfanylquinolin-3-yl]methyl]-2-morpholin-4-yl-2-pyridin-3-ylethanamine Traditional Name: [2-(2-chloroallyloxy)-7-(methylthio)-3-quinolyl]methyl-[2-morpholino-2-(3-pyridyl)ethyl]amine Formula: C25H29ClN4O2S MolecularWeight: 485.04136

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)CNCC(C3=CN=CC=C3)N4CCOCC4)OCC(=C)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)CNCC(C3=CN=CC=C3)N4CCOCC4)OCC(=C)Cl

InChI

InChI=1S/C25H29ClN4O2S/c1-18(26)17-32-25-21(12-19-5-6-22(33-2)13-23(19)29-25)15-28-16-24(20-4-3-7-27-14-20)30-8-10-31-11-9-30/h3-7,12-14,24,28H,1,8-11,15-17H2,2H3