N',N'-diethyl-N-[4-(phenylmethylsulfanyl)quinolin-8-yl]propane-1,3-diamine

Systemtic Name: N',N'-diethyl-N-[4-(phenylmethylsulfanyl)quinolin-8-yl]propane-1,3-diamine Openeye Name: N-(4-benzylsulfanyl-8-quinolyl)-N',N'-diethyl-propane-1,3-diamine CAS Name: N',N'-diethyl-N-[4-(phenylmethylthio)-8-quinolinyl]propane-1,3-diamine IUPAC Name: N-(4-benzylsulfanylquinolin-8-yl)-N',N'-diethylpropane-1,3-diamine Traditional Name: 3-[[4-(benzylthio)-8-quinolyl]amino]propyl-diethyl-amine Formula: C23H29N3S MolecularWeight: 379.56146

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1=CC=CC2=C(C=CN=C21)SCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCCNC1=CC=CC2=C(C=CN=C21)SCC3=CC=CC=C3

InChI

InChI=1S/C23H29N3S/c1-3-26(4-2)17-9-15-24-21-13-8-12-20-22(14-16-25-23(20)21)27-18-19-10-6-5-7-11-19/h5-8,10-14,16,24H,3-4,9,15,17-18H2,1-2H3