6-phenyl-3-[2-(pyrrolidin-1-ylmethyl)quinolin-6-yl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 6-phenyl-3-[2-(pyrrolidin-1-ylmethyl)quinolin-6-yl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 6-phenyl-3-[2-(pyrrolidin-1-ylmethyl)-6-quinolyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 6-phenyl-3-[2-(1-pyrrolidinylmethyl)-6-quinolinyl]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 6-phenyl-3-[2-(pyrrolidin-1-ylmethyl)quinolin-6-yl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 6-phenyl-3-[2-(pyrrolidinomethyl)-6-quinolyl]thieno[3,2-d]pyrimidin-4-one Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=NC3=C(C=C2)C=C(C=C3)N4C=NC5=C(C4=O)SC(=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)CC2=NC3=C(C=C2)C=C(C=C3)N4C=NC5=C(C4=O)SC(=C5)C6=CC=CC=C6

InChI

InChI=1S/C26H22N4OS/c31-26-25-23(15-24(32-25)18-6-2-1-3-7-18)27-17-30(26)21-10-11-22-19(14-21)8-9-20(28-22)16-29-12-4-5-13-29/h1-3,6-11,14-15,17H,4-5,12-13,16H2