N3-methyl-N7-(7-methyldibenzothiophen-3-yl)-N7-phenyl-N3-[4-(trifluoromethyl)phenyl]dibenzothiophene-3,7-diamine

Systemtic Name: N3-methyl-N7-(7-methyldibenzothiophen-3-yl)-N7-phenyl-N3-[4-(trifluoromethyl)phenyl]dibenzothiophene-3,7-diamine Openeye Name: N3-methyl-N7-(7-methyldibenzothiophen-3-yl)-N7-phenyl-N3-[4-(trifluoromethyl)phenyl]dibenzothiophene-3,7-diamine CAS Name: N3-methyl-N7-(7-methyl-3-dibenzothiophenyl)-N7-phenyl-N3-[4-(trifluoromethyl)phenyl]dibenzothiophene-3,7-diamine IUPAC Name: 3-N-methyl-7-N-(7-methyldibenzothiophen-3-yl)-7-N-phenyl-3-N-[4-(trifluoromethyl)phenyl]dibenzothiophene-3,7-diamine Traditional Name: methyl-[7-(N-(7-methyldibenzothiophen-3-yl)anilino)dibenzothiophen-3-yl]-[4-(trifluoromethyl)phenyl]amine Formula: C39H27F3N2S2 MolecularWeight: 644.77029

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C3=C(S2)C=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C(C=C5)C7=C(S6)C=C(C=C7)N(C)C8=CC=C(C=C8)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)C3=C(S2)C=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C(C=C5)C7=C(S6)C=C(C=C7)N(C)C8=CC=C(C=C8)C(F)(F)F

InChI

InChI=1S/C39H27F3N2S2/c1-24-8-16-31-33-18-14-29(22-37(33)45-35(31)20-24)44(27-6-4-3-5-7-27)30-15-19-34-32-17-13-28(21-36(32)46-38(34)23-30)43(2)26-11-9-25(10-12-26)39(40,41)42/h3-23H,1-2H3