N,N'-bis[3-[(4-methoxyphenyl)methylsulfanyl]butyl]-N'-methyl-ethane-1,2-diamine

Systemtic Name: N,N'-bis[3-[(4-methoxyphenyl)methylsulfanyl]butyl]-N'-methyl-ethane-1,2-diamine Openeye Name: N,N'-bis[3-[(4-methoxyphenyl)methylsulfanyl]butyl]-N'-methyl-ethane-1,2-diamine CAS Name: N,N'-bis[3-[(4-methoxyphenyl)methylthio]butyl]-N'-methylethane-1,2-diamine IUPAC Name: N,N'-bis[3-[(4-methoxyphenyl)methylsulfanyl]butyl]-N'-methylethane-1,2-diamine Traditional Name: methyl-[3-(p-anisylthio)butyl]-[2-[3-(p-anisylthio)butylamino]ethyl]amine Formula: C27H42N2O2S2 MolecularWeight: 490.76458

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNCCN(C)CCC(C)SCC1=CC=C(C=C1)OC)SCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(CCNCCN(C)CCC(C)SCC1=CC=C(C=C1)OC)SCC2=CC=C(C=C2)OC

InChI

InChI=1S/C27H42N2O2S2/c1-22(32-20-24-6-10-26(30-4)11-7-24)14-16-28-17-19-29(3)18-15-23(2)33-21-25-8-12-27(31-5)13-9-25/h6-13,22-23,28H,14-21H2,1-5H3