N-[(2-fluorophenyl)methyl]-7,8-dimethoxy-N-(2-morpholin-4-ylethyl)-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: N-[(2-fluorophenyl)methyl]-7,8-dimethoxy-N-(2-morpholin-4-ylethyl)-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: N-[(2-fluorophenyl)methyl]-7,8-dimethoxy-N-(2-morpholinoethyl)-5H-pyrimido[5,4-b]indol-4-amine CAS Name: N-[(2-fluorophenyl)methyl]-7,8-dimethoxy-N-[2-(4-morpholinyl)ethyl]-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: N-[(2-fluorophenyl)methyl]-7,8-dimethoxy-N-(2-morpholin-4-ylethyl)-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: (7,8-dimethoxy-5H-pyrimid[5,4-b]indol-4-yl)-(2-fluorobenzyl)-(2-morpholinoethyl)amine Formula: C25H28FN5O3 MolecularWeight: 465.519923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=C(N2)C(=NC=N3)N(CCN4CCOCC4)CC5=CC=CC=C5F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=C(N2)C(=NC=N3)N(CCN4CCOCC4)CC5=CC=CC=C5F)OC

InChI

InChI=1S/C25H28FN5O3/c1-32-21-13-18-20(14-22(21)33-2)29-24-23(18)27-16-28-25(24)31(8-7-30-9-11-34-12-10-30)15-17-5-3-4-6-19(17)26/h3-6,13-14,16,29H,7-12,15H2,1-2H3