N-methyl-N'-[1-[4-(4-phenylbutylsulfanyl)phenyl]ethyl]propane-1,3-diamine

Systemtic Name: N-methyl-N'-[1-[4-(4-phenylbutylsulfanyl)phenyl]ethyl]propane-1,3-diamine Openeye Name: N-methyl-N'-[1-[4-(4-phenylbutylsulfanyl)phenyl]ethyl]propane-1,3-diamine CAS Name: N-methyl-N'-[1-[4-(4-phenylbutylthio)phenyl]ethyl]propane-1,3-diamine IUPAC Name: N-methyl-N'-[1-[4-(4-phenylbutylsulfanyl)phenyl]ethyl]propane-1,3-diamine Traditional Name: methyl-[3-[1-[4-(4-phenylbutylthio)phenyl]ethylamino]propyl]amine Formula: C22H32N2S MolecularWeight: 356.56788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SCCCCC2=CC=CC=C2)NCCCNC

Isomeric SMILES

CC(C1=CC=C(C=C1)SCCCCC2=CC=CC=C2)NCCCNC

InChI

InChI=1S/C22H32N2S/c1-19(24-17-8-16-23-2)21-12-14-22(15-13-21)25-18-7-6-11-20-9-4-3-5-10-20/h3-5,9-10,12-15,19,23-24H,6-8,11,16-18H2,1-2H3