1-(azepan-1-yl)-2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[[1-[(3-fluorophenyl)methyl]-3-indolyl]thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[1-[(3-fluorophenyl)methyl]indol-3-yl]sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[[1-(3-fluorobenzyl)indol-3-yl]thio]ethanone Formula: C23H25FN2OS MolecularWeight: 396.520803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC(=CC=C4)F

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC(=CC=C4)F

InChI

InChI=1S/C23H25FN2OS/c24-19-9-7-8-18(14-19)15-26-16-22(20-10-3-4-11-21(20)26)28-17-23(27)25-12-5-1-2-6-13-25/h3-4,7-11,14,16H,1-2,5-6,12-13,15,17H2