1-(7-ethyl-1H-indol-3-yl)-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(7-ethyl-1H-indol-3-yl)-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanone Openeye Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-1-(7-ethyl-1H-indol-3-yl)ethanone CAS Name: 1-(7-ethyl-1H-indol-3-yl)-2-[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-1-(7-ethyl-1H-indol-3-yl)ethanone Traditional Name: 2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]-1-(7-ethyl-1H-indol-3-yl)ethanone Formula: C27H22F3N3OS MolecularWeight: 493.54329

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NC4=C(N3CC5=CC=CC=C5)C=CC(=C4)C(F)(F)F

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NC4=C(N3CC5=CC=CC=C5)C=CC(=C4)C(F)(F)F

InChI

InChI=1S/C27H22F3N3OS/c1-2-18-9-6-10-20-21(14-31-25(18)20)24(34)16-35-26-32-22-13-19(27(28,29)30)11-12-23(22)33(26)15-17-7-4-3-5-8-17/h3-14,31H,2,15-16H2,1H3