N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]thio]ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]thio]ethyl]-4-pyrrolidinosulfonyl-benzamide Formula: C27H26FN3O3S2 MolecularWeight: 523.642043

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCSC3=C(NC4=CC=CC=C43)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCSC3=C(NC4=CC=CC=C43)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H26FN3O3S2/c28-21-11-7-19(8-12-21)25-26(23-5-1-2-6-24(23)30-25)35-18-15-29-27(32)20-9-13-22(14-10-20)36(33,34)31-16-3-4-17-31/h1-2,5-14,30H,3-4,15-18H2,(H,29,32)