6,7-dimethoxy-4-[6-(2-thiophen-2-ylpyrrolidin-1-yl)pyridin-3-yl]cinnoline

Systemtic Name: 6,7-dimethoxy-4-[6-(2-thiophen-2-ylpyrrolidin-1-yl)pyridin-3-yl]cinnoline Openeye Name: 6,7-dimethoxy-4-[6-[2-(2-thienyl)pyrrolidin-1-yl]-3-pyridyl]cinnoline CAS Name: 6,7-dimethoxy-4-[6-(2-thiophen-2-yl-1-pyrrolidinyl)-3-pyridinyl]cinnoline IUPAC Name: 6,7-dimethoxy-4-[6-(2-thiophen-2-ylpyrrolidin-1-yl)pyridin-3-yl]cinnoline Traditional Name: 6,7-dimethoxy-4-[6-[2-(2-thienyl)pyrrolidino]-3-pyridyl]cinnoline Formula: C23H22N4O2S MolecularWeight: 418.51138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CN=N2)C3=CN=C(C=C3)N4CCCC4C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CN=N2)C3=CN=C(C=C3)N4CCCC4C5=CC=CS5)OC

InChI

InChI=1S/C23H22N4O2S/c1-28-20-11-16-17(14-25-26-18(16)12-21(20)29-2)15-7-8-23(24-13-15)27-9-3-5-19(27)22-6-4-10-30-22/h4,6-8,10-14,19H,3,5,9H2,1-2H3