N1-[2-(dodecylsulfanylmethyl)phenyl]-N4-(4-methylpentan-2-yl)benzene-1,4-diamine

Systemtic Name: N1-[2-(dodecylsulfanylmethyl)phenyl]-N4-(4-methylpentan-2-yl)benzene-1,4-diamine Openeye Name: N4-(1,3-dimethylbutyl)-N1-[2-(dodecylsulfanylmethyl)phenyl]benzene-1,4-diamine CAS Name: N1-[2-[(dodecylthio)methyl]phenyl]-N4-(4-methylpentan-2-yl)benzene-1,4-diamine IUPAC Name: 1-N-[2-(dodecylsulfanylmethyl)phenyl]-4-N-(4-methylpentan-2-yl)benzene-1,4-diamine Traditional Name: 1,3-dimethylbutyl-[4-[2-[(laurylthio)methyl]anilino]phenyl]amine Formula: C31H50N2S MolecularWeight: 482.8071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC1=CC=CC=C1NC2=CC=C(C=C2)NC(C)CC(C)C

Isomeric SMILES

CCCCCCCCCCCCSCC1=CC=CC=C1NC2=CC=C(C=C2)NC(C)CC(C)C

InChI

InChI=1S/C31H50N2S/c1-5-6-7-8-9-10-11-12-13-16-23-34-25-28-17-14-15-18-31(28)33-30-21-19-29(20-22-30)32-27(4)24-26(2)3/h14-15,17-22,26-27,32-33H,5-13,16,23-25H2,1-4H3