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N1,N4-bis[2-(octylsulfanylmethyl)phenyl]benzene-1,4-diamine

N1,N4-bis[2-(octylsulfanylmethyl)phenyl]benzene-1,4-diamine

Systemtic Name:N1,N4-bis[2-(octylsulfanylmethyl)phenyl]benzene-1,4-diamine
Openeye Name:N1,N4-bis[2-(octylsulfanylmethyl)phenyl]benzene-1,4-diamine
CAS Name:N1,N4-bis[2-[(octylthio)methyl]phenyl]benzene-1,4-diamine
IUPAC Name:1-N,4-N-bis[2-(octylsulfanylmethyl)phenyl]benzene-1,4-diamine
Traditional Name:[4-[2-[(octylthio)methyl]anilino]phenyl]-[2-[(octylthio)methyl]phenyl]amine
Formula: C36H52N2S2
MolecularWeight: 576.94148
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCC1=CC=CC=C1NC2=CC=C(C=C2)NC3=CC=CC=C3CSCCCCCCCC


Isomeric SMILES

CCCCCCCCSCC1=CC=CC=C1NC2=CC=C(C=C2)NC3=CC=CC=C3CSCCCCCCCC


InChI

InChI=1S/C36H52N2S2/c1-3-5-7-9-11-17-27-39-29-31-19-13-15-21-35(31)37-33-23-25-34(26-24-33)38-36-22-16-14-20-32(36)30-40-28-18-12-10-8-6-4-2/h13-16,19-26,37-38H,3-12,17-18,27-30H2,1-2H3


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