1-[5-fluoranyl-3-(pyridin-3-ylmethyl)indol-1-yl]-1-hexyl-urea

Systemtic Name: 1-[5-fluoranyl-3-(pyridin-3-ylmethyl)indol-1-yl]-1-hexyl-urea Openeye Name: 1-[5-fluoro-3-(3-pyridylmethyl)indol-1-yl]-1-hexyl-urea CAS Name: 1-[5-fluoro-3-(3-pyridinylmethyl)-1-indolyl]-1-hexylurea IUPAC Name: 1-[5-fluoro-3-(pyridin-3-ylmethyl)indol-1-yl]-1-hexylurea Traditional Name: 1-[5-fluoro-3-(3-pyridylmethyl)indol-1-yl]-1-hexyl-urea Formula: C21H25FN4O MolecularWeight: 368.447803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(=O)N)N1C=C(C2=C1C=CC(=C2)F)CC3=CN=CC=C3

Isomeric SMILES

CCCCCCN(C(=O)N)N1C=C(C2=C1C=CC(=C2)F)CC3=CN=CC=C3

InChI

InChI=1S/C21H25FN4O/c1-2-3-4-5-11-25(21(23)27)26-15-17(12-16-7-6-10-24-14-16)19-13-18(22)8-9-20(19)26/h6-10,13-15H,2-5,11-12H2,1H3,(H2,23,27)