4-[2-dibenzothiophen-2-yl-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-dibenzothiophen-2-yl-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-dibenzothiophen-2-yl-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(2-dibenzothiophenyl)-7-(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-dibenzothiophen-2-yl-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-dibenzothiophen-2-yl-7-(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C25H21F3N2S MolecularWeight: 438.50785

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)C4=C(C5=C(N4)C(=CC=C5)C(F)(F)F)CCCCN

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)C4=C(C5=C(N4)C(=CC=C5)C(F)(F)F)CCCCN

InChI

InChI=1S/C25H21F3N2S/c26-25(27,28)20-9-5-8-18-17(7-3-4-13-29)23(30-24(18)20)15-11-12-22-19(14-15)16-6-1-2-10-21(16)31-22/h1-2,5-6,8-12,14,30H,3-4,7,13,29H2