2-[(3-bromophenyl)-(4-butylsulfanylphenyl)methyl]sulfanyl-N,N-diethyl-ethanamine

Systemtic Name: 2-[(3-bromophenyl)-(4-butylsulfanylphenyl)methyl]sulfanyl-N,N-diethyl-ethanamine Openeye Name: 2-[(3-bromophenyl)-(4-butylsulfanylphenyl)methyl]sulfanyl-N,N-diethyl-ethanamine CAS Name: 2-[[(3-bromophenyl)-[4-(butylthio)phenyl]methyl]thio]-N,N-diethylethanamine IUPAC Name: 2-[(3-bromophenyl)-(4-butylsulfanylphenyl)methyl]sulfanyl-N,N-diethylethanamine Traditional Name: 2-[[(3-bromophenyl)-[4-(butylthio)phenyl]methyl]thio]ethyl-diethyl-amine Formula: C23H32BrNS2 MolecularWeight: 466.54088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)C(C2=CC(=CC=C2)Br)SCCN(CC)CC

Isomeric SMILES

CCCCSC1=CC=C(C=C1)C(C2=CC(=CC=C2)Br)SCCN(CC)CC

InChI

InChI=1S/C23H32BrNS2/c1-4-7-16-26-22-13-11-19(12-14-22)23(20-9-8-10-21(24)18-20)27-17-15-25(5-2)6-3/h8-14,18,23H,4-7,15-17H2,1-3H3