N,N'-bis[3-[(5-chloranyl-2-phenylsulfanyl-phenyl)amino]propyl]propane-1,3-diamine

Systemtic Name: N,N'-bis[3-[(5-chloranyl-2-phenylsulfanyl-phenyl)amino]propyl]propane-1,3-diamine Openeye Name: N,N'-bis[3-(5-chloro-2-phenylsulfanyl-anilino)propyl]propane-1,3-diamine CAS Name: N,N'-bis[3-[5-chloro-2-(phenylthio)anilino]propyl]propane-1,3-diamine IUPAC Name: N,N'-bis[3-(5-chloro-2-phenylsulfanylanilino)propyl]propane-1,3-diamine Traditional Name: 3-[5-chloro-2-(phenylthio)anilino]propyl-[3-[3-[5-chloro-2-(phenylthio)anilino]propylamino]propyl]amine Formula: C33H38Cl2N4S2 MolecularWeight: 625.71762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=C(C=C2)Cl)NCCCNCCCNCCCNC3=C(C=CC(=C3)Cl)SC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=C(C=C2)Cl)NCCCNCCCNCCCNC3=C(C=CC(=C3)Cl)SC4=CC=CC=C4

InChI

InChI=1S/C33H38Cl2N4S2/c34-26-14-16-32(40-28-10-3-1-4-11-28)30(24-26)38-22-8-20-36-18-7-19-37-21-9-23-39-31-25-27(35)15-17-33(31)41-29-12-5-2-6-13-29/h1-6,10-17,24-25,36-39H,7-9,18-23H2