5,6-dimethyl-2-(5-quinolin-8-ylsulfanylfuran-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-(5-quinolin-8-ylsulfanylfuran-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[5-(8-quinolylsulfanyl)-2-furyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[5-(8-quinolinylthio)-2-furanyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-(5-quinolin-8-ylsulfanylfuran-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[5-(8-quinolylthio)-2-furyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H15N3O2S2 MolecularWeight: 405.4927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C3=CC=C(O3)SC4=CC=CC5=C4N=CC=C5)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C3=CC=C(O3)SC4=CC=CC5=C4N=CC=C5)C

InChI

InChI=1S/C21H15N3O2S2/c1-11-12(2)27-21-17(11)20(25)23-19(24-21)14-8-9-16(26-14)28-15-7-3-5-13-6-4-10-22-18(13)15/h3-10H,1-2H3,(H,23,24,25)