N,N'-bis[3-[(4-methylsulfanylphenyl)methylamino]propyl]heptane-1,7-diamine

Systemtic Name: N,N'-bis[3-[(4-methylsulfanylphenyl)methylamino]propyl]heptane-1,7-diamine Openeye Name: N,N'-bis[3-[(4-methylsulfanylphenyl)methylamino]propyl]heptane-1,7-diamine CAS Name: N,N'-bis[3-[[4-(methylthio)phenyl]methylamino]propyl]heptane-1,7-diamine IUPAC Name: N,N'-bis[3-[(4-methylsulfanylphenyl)methylamino]propyl]heptane-1,7-diamine Traditional Name: [4-(methylthio)benzyl]-[3-[7-[3-[[4-(methylthio)benzyl]amino]propylamino]heptylamino]propyl]amine Formula: C29H48N4S2 MolecularWeight: 516.84822

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNCCCNCCCCCCCNCCCNCC2=CC=C(C=C2)SC

Isomeric SMILES

CSC1=CC=C(C=C1)CNCCCNCCCCCCCNCCCNCC2=CC=C(C=C2)SC

InChI

InChI=1S/C29H48N4S2/c1-34-28-14-10-26(11-15-28)24-32-22-8-20-30-18-6-4-3-5-7-19-31-21-9-23-33-25-27-12-16-29(35-2)17-13-27/h10-17,30-33H,3-9,18-25H2,1-2H3