3-(4-ethoxyphenyl)-1-[2-(5-fluoranyl-2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(4-ethoxyphenyl)-1-[2-(5-fluoranyl-2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(4-ethoxyphenyl)-1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-(4-pyridylmethyl)thiourea CAS Name: 3-(4-ethoxyphenyl)-1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(4-ethoxyphenyl)-1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-3-p-phenetyl-1-(4-pyridylmethyl)thiourea Formula: C26H27FN4OS MolecularWeight: 462.582183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CCC2=C(NC3=C2C=C(C=C3)F)C)CC4=CC=NC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CCC2=C(NC3=C2C=C(C=C3)F)C)CC4=CC=NC=C4

InChI

InChI=1S/C26H27FN4OS/c1-3-32-22-7-5-21(6-8-22)30-26(33)31(17-19-10-13-28-14-11-19)15-12-23-18(2)29-25-9-4-20(27)16-24(23)25/h4-11,13-14,16,29H,3,12,15,17H2,1-2H3,(H,30,33)